TYR_ITK (Tyrosine-protein kinase ITK/TSK)

Total number of chains: 59
Active chains: 2
Uniprot: ITK_HUMAN
Kinase Domain Residues: 363 - 614
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 25 42.4% 4RFMA
DFGin BLBplus 21 35.6% 9NWXA
DFGin None 10 16.9% 4PQNA
DFGin BLAminus 3 5.1% AF-Q08881-K1A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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Gene PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
ITK AF-Q08881-K1A Q08881 355 620 620.0 No_ligand No_ligand Active DFGin 6.8214 13.9075 BLAminus -136.24, -175.79 55.48, 69.15 -84.68, 14.38 297.44, 87.73 -59.11, -31.45 in-in in 8.5169 Saltbr-in 2.6683 HRD-in -76.35, -40.21 67.29, -20.01 in-in-in SNCiii in-in ActLoopNT-in 2.9949 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.3, 148.47 APE9-dihe-in -144.93, 156.29 APE8-dihe-in -75.22, 86.83 APE8-rot-na 32.7 APE67-dihe-in -68.82, -16.14 -43.59, -41.61 APE12-dist-na 14.8323 APE11-dist-na 9.9539 APE10-dist-na 11.6241 APE9-dist-in 6.7433 None None None AF2 -1.0 1.0 1.0 A 266.0 266.0 0 29 29 0 [[363, 614]] 1.0 AF-Q08881-K1 TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK AF-Q08881-K3A Q08881 355 620 620.0 No_ligand No_ligand Active DFGin 6.5024 13.9854 BLAminus -144.79, -174.87 55.86, 66.43 -79.5, 8.16 297.06, 87.75 -59.87, -25.16 in-in in 9.038 Saltbr-in 2.7194 HRD-in -79.2, -42.03 68.19, -14.89 in-in-in SNCiii in-in ActLoopNT-in 2.8904 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -70.4, 141.24 APE9-dihe-in -149.38, 158.97 APE8-dihe-in -78.23, 79.46 APE8-rot-na 37.36 APE67-dihe-in -71.52, -13.15 -44.16, -41.92 APE12-dist-na 13.8458 APE11-dist-na 9.0808 APE10-dist-na 9.903 APE9-dist-in 5.7563 None None None AF2 -1.0 1.0 1.0 A 266.0 266.0 0 29 29 0 [[363, 614]] 1.0 AF-Q08881-K3 TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3MIYB Q08881 357 619 620.0 B49:60002 Type1 Inactive DFGin 4.594 14.3076 BLAplus -119.14, 168.78 58.23, 44.95 -107.27, 10.53 54.14, 85.29 -87.92, 999.0 in-out in 9.7941 Saltbr-out 4.8729 HRD-in -72.48, -51.01 80.11, -14.33 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 102.33 APE8-rot-na 353.07 APE67-dihe-in -63.42, -24.1 -64.07, -27.41 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.67 0.208 0.234 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 3miy TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4MF1A Q08881 357 619 620.0 29Y:60701 Type1 Inactive DFGin 4.2916 14.4868 BLAplus -128.58, 173.62 47.23, 44.4 -102.38, 27.38 55.51, 83.16 -123.42, 25.0 in-out in 9.9354 Saltbr-out 4.2678 HRD-in -68.56, -53.29 81.24, -14.67 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 79.97 APE8-rot-na 27.54 APE67-dihe-in -68.46, -18.99 -58.04, -26.43 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 2.113 0.177 0.229 A 266.0 241.0 22 29 12 17 [[363, 614]] 1.0 4mf1 TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4MF1B Q08881 357 619 620.0 29Y:60701 Type1 Inactive DFGin 4.7416 14.3428 BLAplus -124.99, 172.1 51.55, 46.86 -105.12, 12.48 45.0, 90.17 -92.77, -1.83 in-out in 9.8193 Saltbr-out 4.4817 HRD-in -69.32, -50.71 79.01, -15.78 out-out-out SNCooo out-out ActLoopNT-out 7.3257 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, -64.99 APE8-dihe-in -85.8, 80.1 APE8-rot-na 32.91 APE67-dihe-in -59.48, -20.2 -53.72, -34.91 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.7248 C477S,E614A,E617A None None XRAY 2.113 0.177 0.229 B 266.0 244.0 19 29 15 14 [[363, 614]] 1.0 4mf1 TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4RFMA Q08881 357 618 620.0 3P6:60701 Type1 Inactive DFGin 5.6956 14.6922 BLAplus -130.1, -172.88 61.29, 32.56 -100.81, 1.34 57.0, 90.97 -146.78, 171.8 out-out out 14.6304 Saltbr-out 14.9508 HRD-in -71.39, -57.57 80.34, -7.79 out-out-out SNCooo out-out ActLoopNT-out 10.9555 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 120.86 APE8-dihe-in -87.67, 76.64 APE8-rot-na 29.6 APE67-dihe-in -56.13, -18.2 -56.22, -35.15 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.6419 C477S,E614A,E617A None None XRAY 2.1 0.206 0.264 A 266.0 248.0 14 29 15 14 [[363, 614]] 1.0 4rfm TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4KIOA Q08881 357 619 620.0 G5K:60701 Type1 Inactive DFGin 4.3753 14.7019 BLAplus -118.58, 173.69 46.99, 49.02 -104.86, 13.72 51.45, 89.71 -108.9, 22.66 out-out out 10.2411 Saltbr-out 6.477 HRD-in -69.61, -55.38 85.37, -11.53 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 96.8 APE8-rot-na 340.24 APE67-dihe-in -69.13, -18.83 -56.58, -22.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 A 266.0 238.0 25 29 13 16 [[363, 614]] 1.0 4kio TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4KIOB Q08881 357 619 620.0 G5K:60701 Type1 Inactive DFGin 4.2952 14.7129 BLAplus -122.69, 175.7 46.04, 47.6 -101.28, 10.89 51.75, 87.37 -102.32, 15.74 out-out out 10.2531 Saltbr-out 5.7795 HRD-in -67.94, -55.39 83.83, -14.35 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 57.92 APE8-rot-na 30.1 APE67-dihe-in -63.89, -21.23 -61.05, -22.92 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 B 266.0 237.0 26 29 13 16 [[363, 614]] 1.0 4kio TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4KIOD Q08881 357 618 620.0 G6K:60701 Type1 Inactive DFGin 4.3176 14.943 BLAplus -116.62, 177.25 41.84, 49.19 -104.11, 15.35 56.06, 88.31 -106.43, 8.49 out-out out 10.4684 Saltbr-out 6.034 HRD-in -72.72, -56.36 82.16, -14.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 72.7 APE8-rot-na 32.65 APE67-dihe-in -60.87, -19.97 -56.03, -25.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 D 266.0 240.0 22 29 12 17 [[363, 614]] 1.0 4kio TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4L7SA Q08881 357 620 620.0 G7K:60701 Type1 Inactive DFGin 4.3212 14.4343 BLAplus -124.59, 171.94 51.32, 50.71 -109.92, 5.46 56.29, 89.14 -102.46, 17.01 in-out in 9.7402 Saltbr-out 5.3337 HRD-in -76.58, -50.89 82.84, -20.81 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 76.81 APE8-rot-na 357.82 APE67-dihe-in -66.8, -22.86 -59.01, -24.44 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.03 0.174 0.221 A 266.0 248.0 16 29 13 16 [[363, 614]] 1.0 4l7s TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4L7SB Q08881 357 620 620.0 G7K:60701 Type1 Inactive DFGin 4.1978 14.392 BLAplus -124.02, 169.18 48.34, 47.86 -102.54, 11.12 54.89, 92.04 -109.98, 19.4 in-out in 9.8607 Saltbr-out 5.1345 HRD-in -72.3, -56.34 84.23, -15.49 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 72.72 APE8-rot-na 1.37 APE67-dihe-in -61.64, -23.89 -56.78, -30.01 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.03 0.174 0.221 B 266.0 248.0 16 29 13 16 [[363, 614]] 1.0 4l7s TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4MF0A Q08881 357 619 620.0 29Z:701 Type1 Inactive DFGin 7.1006 14.4248 BLAplus -143.98, 170.19 56.85, 56.33 -101.39, -51.6 26.45, 98.65 -110.48, 47.98 out-out out 13.7182 Saltbr-out 14.166 HRD-in -56.64, -44.55 74.19, -20.92 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -32.27 APE8-rot-na 25.9 APE67-dihe-in -64.12, -28.5 -67.87, -25.3 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.215 0.268 A 266.0 240.0 23 29 13 16 [[363, 614]] 1.0 4mf0 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PP9A Q08881 357 619 620.0 2VT:60703 Type1 Inactive DFGin 4.5741 14.3768 BLAplus -129.82, 173.12 60.62, 46.22 -109.56, 65.21 50.22, 98.43 -109.57, 999.0 in-out in 9.6225 Saltbr-out 6.2278 HRD-in -69.9, -46.84 72.12, -13.05 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 46.87 APE8-rot-na 7.97 APE67-dihe-in -59.81, -20.4 -60.0, -37.67 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.58 0.226 0.284 A 266.0 245.0 18 29 11 18 [[363, 614]] 1.0 4pp9 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PP9B Q08881 357 619 620.0 2VT:60701 Type1 Inactive DFGin 4.7151 14.1683 BLAplus -138.23, 168.78 63.5, 44.16 -112.36, 32.92 51.03, 84.48 -116.59, 30.97 in-out in 9.7257 Saltbr-out 6.0652 HRD-in -67.7, -52.74 75.42, -11.53 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 0.48 APE8-rot-na 28.82 APE67-dihe-in -67.24, -9.86 -58.99, -34.05 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.58 0.226 0.284 B 266.0 246.0 17 29 12 17 [[363, 614]] 1.0 4pp9 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4QD6A Q08881 357 619 620.0 30T:60701 Type1 Inactive DFGin 6.5092 13.7336 BLAplus -132.38, -177.15 51.25, 38.99 -87.87, -18.58 45.6, 90.99 -54.76, -85.16 out-out out 12.6343 Saltbr-out 11.4229 HRD-in -64.17, -59.7 95.32, -29.76 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -33.01 APE8-rot-na 30.41 APE67-dihe-in -61.7, -24.35 -58.27, -31.76 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.45 0.212 0.267 A 266.0 242.0 21 29 13 16 [[363, 614]] 1.0 4qd6 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3QGWA Q08881 358 618 620.0 PQC:1 Type1 Inactive DFGin 4.9728 13.0876 BLAplus -131.51, -179.94 53.74, 33.71 -89.79, -22.03 54.92, 80.2 -84.37, 999.0 out-out out 11.5976 Saltbr-out 6.3948 HRD-in -92.02, -0.19 23.56, -1.23 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 169.21 APE8-dihe-in -72.23, 65.56 APE8-rot-na 339.97 APE67-dihe-in -68.71, -19.0 -63.58, -17.46 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.0205 None None None XRAY 2.1 0.245 0.32 A 286.0 244.0 17 29 12 17 [[363, 614]] 1.0 3qgw TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3QGYA Q08881 357 618 620.0 PQC:60001 Type1 Inactive DFGin 4.7023 13.3978 BLAplus -130.17, 173.6 58.05, 28.5 -83.19, -21.92 53.94, 76.12 -98.05, 999.0 out-out out 10.7365 Saltbr-out 7.447 HRD-in -73.36, -56.75 77.34, -6.04 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.92 APE8-rot-na 332.56 APE67-dihe-in -71.07, -15.83 -62.67, -17.28 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.208 0.247 A 286.0 244.0 18 29 11 18 [[363, 614]] 1.0 3qgy TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5JA Q08881 357 618 620.0 0F2:60701 Type1 Inactive DFGin 4.2713 14.4308 BLAplus -118.52, 160.44 57.13, 61.88 -107.71, -6.19 47.25, 95.66 -84.37, 999.0 out-none out 10.0149 Saltbr-none 999.0 HRD-out -87.3, 100.32 -72.15, -10.02 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 36.8 APE8-rot-na 22.05 APE67-dihe-in -63.51, -32.51 -68.68, -23.04 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.59 0.246 0.27 A 266.0 239.0 23 29 11 18 [[363, 614]] 1.0 3v5j TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5LA Q08881 357 616 620.0 0G1:60701 Type1 Inactive DFGin 4.1338 14.7047 BLAplus -115.85, 171.01 48.27, 46.07 -96.05, 11.31 58.96, 91.61 -107.31, 8.54 out-none out 10.1449 Saltbr-none 999.0 HRD-in -65.69, -47.42 74.14, -16.58 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 142.05 APE8-rot-na 332.57 APE67-dihe-in -62.15, -19.85 -69.15, -18.57 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 1.86 0.232 0.252 A 266.0 238.0 22 29 13 16 [[363, 614]] 1.0 3v5l TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5LB Q08881 357 619 620.0 0G1:60701 Type1 Inactive DFGin 4.1399 14.6499 BLAplus -115.25, 172.45 47.57, 47.21 -97.73, 8.05 59.86, 89.65 -107.55, 11.69 out-out out 10.0753 Saltbr-out 5.3889 HRD-in -66.97, -47.64 75.37, -19.95 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -28.51 APE8-rot-na 26.38 APE67-dihe-in -61.19, -18.82 -58.23, -34.87 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 1.86 0.232 0.252 B 266.0 239.0 24 29 13 16 [[363, 614]] 1.0 3v5l TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5LC Q08881 357 616 620.0 0G1:60701 Type1 Inactive DFGin 4.151 14.49 BLAplus -119.43, 171.57 47.86, 45.98 -95.4, 6.02 56.69, 90.24 -103.84, 4.9 in-out in 9.9164 Saltbr-out 5.4292 HRD-in -67.67, -52.97 78.54, -20.18 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 134.05 APE8-dihe-out -64.27, -25.66 APE8-rot-na 343.98 APE67-dihe-in -64.94, -21.62 -63.54, -24.83 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.2825 None None None XRAY 1.86 0.232 0.252 C 266.0 242.0 18 29 14 15 [[363, 614]] 1.0 3v5l TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5LD Q08881 357 619 620.0 0G1:60701 Type1 Inactive DFGin 4.1221 14.5366 BLAplus -118.73, 170.46 50.59, 44.65 -96.3, 5.17 58.81, 89.99 -103.3, 10.97 out-out out 10.0127 Saltbr-out 5.4138 HRD-in -69.59, -48.92 76.64, -24.59 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 84.06 APE8-dihe-out -96.47, -61.68 APE8-rot-na 21.65 APE67-dihe-in -60.91, -18.81 -64.24, -17.65 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.5568 None None None XRAY 1.86 0.232 0.252 D 266.0 244.0 19 29 13 16 [[363, 614]] 1.0 3v5l TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V8TA Q08881 357 618 620.0 477:60701 Type1 Inactive DFGin 4.2315 14.4642 BLAplus -118.95, 167.7 48.94, 50.18 -99.3, 5.63 54.69, 89.09 -99.94, 4.7 out-out out 10.0529 Saltbr-out 4.3112 HRD-in -68.26, -49.95 78.02, -22.27 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 178.92 APE8-rot-na 331.13 APE67-dihe-in -62.92, -38.74 -155.44, -29.56 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.0 0.221 0.248 A 266.0 236.0 26 29 12 17 [[363, 614]] 1.0 3v8t TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V8TB Q08881 357 619 620.0 477:60701 Type1 Inactive DFGin 4.2401 14.4304 BLAplus -118.41, 168.07 51.0, 46.57 -97.03, 4.16 57.29, 90.12 -98.81, 3.03 out-none out 10.0608 Saltbr-none 999.0 HRD-in -66.81, -51.51 78.21, -18.77 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 84.89 APE8-rot-na 330.19 APE67-dihe-in -61.4, -24.89 -59.94, -28.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.0 0.221 0.248 B 266.0 242.0 21 29 13 16 [[363, 614]] 1.0 3v8t TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V8WA Q08881 357 619 620.0 0G2:60701 Type1 Inactive DFGin 4.1401 14.4342 BLAplus -119.79, 170.29 59.08, 31.97 -85.94, -7.64 58.52, 91.96 -70.44, 999.0 out-none out 10.5013 Saltbr-none 999.0 HRD-in -68.04, -41.85 72.31, -23.68 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 79.4 APE8-rot-na 22.7 APE67-dihe-in -61.79, -33.9 -87.14, -15.62 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.27 0.252 0.268 A 266.0 241.0 22 29 11 18 [[363, 614]] 1.0 3v8w TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V8WB Q08881 357 619 620.0 0G2:60702 Type1 Inactive DFGin 4.2515 14.4975 BLAplus -115.32, 167.75 61.24, 31.37 -84.42, -9.7 58.09, 92.42 -87.94, 999.0 out-none out 10.6916 Saltbr-none 999.0 HRD-in -66.06, -47.99 75.65, -16.62 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 138.4 APE8-rot-na 24.46 APE67-dihe-in -62.86, -34.17 -86.74, -6.01 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.27 0.252 0.268 B 266.0 240.0 23 29 11 18 [[363, 614]] 1.0 3v8w TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4KIOC Q08881 357 620 620.0 G6K:60701,G5K:60702 Type1,Type1 Inactive DFGin 4.3958 14.6888 BLAplus -123.89, 178.68 54.44, 40.53 -101.16, 11.51 53.39, 88.01 -105.65, 3.86 out-out out 10.054 Saltbr-out 5.6585 HRD-in -74.91, -55.25 81.74, -10.36 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 89.85 APE8-dihe-out -60.01, -29.11 APE8-rot-na 27.38 APE67-dihe-in -70.11, -21.52 -53.02, -24.29 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.2438 Y512E None None XRAY 2.18 0.167 0.202 C 266.0 249.0 15 29 14 15 [[363, 614]] 1.0 4kio TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SNXA Q08881 357 619 620.0 No_ligand No_ligand Inactive DFGin 5.3728 13.4608 BLBplus -148.45, -167.42 58.81, 12.72 -82.43, -172.25 53.12, 132.58 94.98, 999.0 out-out out 11.6603 Saltbr-out 7.1783 HRD-out -68.86, 105.83 -82.58, 39.73 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 26.12 APE8-rot-na 324.61 APE67-dihe-in -48.54, -49.15 -61.72, -27.92 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 3.2 0.271 0.296 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snx TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SNXB Q08881 357 619 620.0 No_ligand No_ligand Inactive DFGin 5.7953 13.105 BLBplus -168.37, -173.82 67.22, 2.08 -70.51, -158.27 49.86, 149.68 88.41, 999.0 out-out out 11.3392 Saltbr-out 7.4999 HRD-out -66.67, 86.47 -66.74, 48.69 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 46.42 APE8-rot-na 325.34 APE67-dihe-in -35.46, -58.25 -69.23, -38.36 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 3.2 0.271 0.296 B 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snx TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3MJ2A Q08881 357 615 620.0 MJG:1 Type1 Inactive DFGin 5.6353 14.566 BLBplus -129.73, 165.59 57.96, 29.14 -59.86, 130.89 36.54, 95.94 74.56, 1.89 out-out out 15.1105 Saltbr-out 16.1446 HRD-in -66.78, -53.43 86.15, -22.26 out-out-out SNCooo out-out ActLoopNT-out 7.7434 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -103.95, 8.69 APE9-dihe-in -65.75, 130.65 APE8-dihe-in -71.52, 63.99 APE8-rot-na 27.29 APE67-dihe-in -64.94, -20.79 -56.06, -33.73 APE12-dist-na 16.7617 APE11-dist-na 19.2905 APE10-dist-na 14.5721 APE9-dist-out 8.9381 C477S,E614A,E617A None None XRAY 1.9 0.208 0.252 A 266.0 259.0 0 29 29 0 [[363, 614]] 1.0 3mj2 TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPAA Q08881 357 619 620.0 2VU:60701 Type1 Inactive DFGin 6.408 13.5479 BLBplus -130.29, 170.67 58.49, 42.81 -95.59, 145.08 43.49, 93.78 142.48, 999.0 out-out out 12.5034 Saltbr-out 10.969 HRD-out -77.83, 144.82 -111.74, -5.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -44.5 APE8-rot-na 21.29 APE67-dihe-in -59.97, -32.38 -62.98, -33.05 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.237 0.278 A 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppa TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPAB Q08881 357 619 620.0 2VU:60701 Type1 Inactive DFGin 6.5195 13.6707 BLBplus -131.72, 177.67 58.91, 33.55 -89.94, 137.79 45.37, 86.14 178.27, 999.0 out-out out 12.9502 Saltbr-out 11.0848 HRD-out -90.04, 92.95 -68.76, 1.92 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -31.04 APE8-rot-na 27.17 APE67-dihe-in -62.28, -21.32 -65.84, -33.0 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.237 0.278 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppa TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPBA Q08881 357 619 620.0 2VV:60701 Type1 Inactive DFGin 6.8705 13.6353 BLBplus -134.69, 173.46 62.47, 48.87 -112.54, 114.52 48.77, 99.62 179.54, 999.0 out-out out 12.4379 Saltbr-out 10.5108 HRD-in -68.02, -57.27 82.05, -12.41 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -34.6 APE8-rot-na 25.65 APE67-dihe-in -49.89, -39.85 -57.53, -38.31 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.82 0.214 0.266 A 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppb TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPBB Q08881 357 619 620.0 2VV:60701 Type1 Inactive DFGin 6.8336 14.0088 BLBplus -138.14, 179.9 61.49, 31.68 -97.02, 135.52 54.08, 93.82 97.86, 999.0 out-out out 12.7993 Saltbr-out 12.2513 HRD-in -73.75, -53.09 75.89, -15.15 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -0.43 APE8-rot-na 27.03 APE67-dihe-in -53.1, -26.37 -54.4, -38.45 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.82 0.214 0.266 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppb TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4QD6B Q08881 357 619 620.0 30T:60701 Type1 Inactive DFGin 6.43 13.3454 BLBplus -124.32, 178.2 63.05, 48.97 -116.35, 143.6 42.38, 90.89 85.03, 100.78 out-out out 12.2584 Saltbr-out 7.6567 HRD-in -67.53, -57.21 95.66, -55.07 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 120.42 APE8-rot-na 334.31 APE67-dihe-in -66.95, -30.25 -76.29, -6.4 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.45 0.212 0.267 B 266.0 241.0 22 29 13 16 [[363, 614]] 1.0 4qd6 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SM2A Q08881 357 619 620.0 STU:301 Type1 Inactive DFGin 5.4974 13.3207 BLBplus -148.18, -157.96 48.2, 18.11 -92.5, -172.62 59.26, 91.5 71.27, 999.0 out-out out 10.5039 Saltbr-out 8.0102 HRD-out -81.72, 93.89 -66.35, 12.1 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 67.52 APE8-rot-na 340.44 APE67-dihe-in -77.92, -11.34 -60.73, -6.74 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.3 0.246 0.292 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1sm2 TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SNUA Q08881 357 619 620.0 STU:301 Type1 Inactive DFGin 5.4095 13.5857 BLBplus -121.03, -147.07 39.99, 19.77 -95.61, 161.03 65.42, 97.15 81.16, 999.0 out-out out 10.9852 Saltbr-out 7.7298 HRD-out -99.78, 92.32 -72.7, 37.05 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 62.98 APE8-rot-na 339.02 APE67-dihe-in -71.29, -26.27 -59.31, -15.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.5 0.262 0.295 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snu TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4HCTA Q08881 354 618 620.0 18R:701 Type1 Inactive DFGin 6.557 15.146 BLBplus -128.45, 162.21 70.18, 18.36 -59.19, 130.98 39.81, 91.57 71.92, -1.6 out-out out 15.687 Saltbr-out 17.4566 HRD-in -67.59, -54.72 86.79, -22.97 out-out-out SNCooo out-out ActLoopNT-out 7.6703 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.04, 10.58 APE9-dihe-in -67.52, 136.72 APE8-dihe-in -78.72, 62.88 APE8-rot-na 32.19 APE67-dihe-in -57.37, -24.33 -56.88, -35.68 APE12-dist-na 17.2477 APE11-dist-na 19.4488 APE10-dist-na 14.6903 APE9-dist-out 8.9793 K596R None None XRAY 1.48 0.172 0.184 A 269.0 265.0 0 29 29 0 [[363, 614]] 1.0 4hct TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4HCUA Q08881 356 618 620.0 13L:701 Type1 Inactive DFGin 6.484 15.2164 BLBplus -122.04, 165.04 71.22, 16.71 -57.18, 130.79 39.32, 95.0 73.43, -2.82 out-out out 15.7902 Saltbr-out 17.9986 HRD-in -67.74, -56.29 87.8, -21.62 out-out-out SNCooo out-out ActLoopNT-out 7.8004 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.12, 8.58 APE9-dihe-in -67.8, 136.48 APE8-dihe-in -77.15, 62.05 APE8-rot-na 28.78 APE67-dihe-in -64.33, -16.67 -57.63, -35.53 APE12-dist-na 16.7816 APE11-dist-na 19.1772 APE10-dist-na 14.3901 APE9-dist-out 8.8665 K596R None None XRAY 1.43 0.17 0.191 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4hcu TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4HCVA Q08881 356 618 620.0 13J:701 Type1 Inactive DFGin 6.7055 14.9965 BLBplus -134.36, 168.09 71.48, 14.63 -58.41, 126.24 33.04, 92.99 79.45, -5.95 out-out out 15.7255 Saltbr-out 18.3258 HRD-in -68.44, -51.85 85.01, -27.11 out-out-out SNCooo out-out ActLoopNT-out 7.7591 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -114.1, 12.26 APE9-dihe-in -64.3, 132.51 APE8-dihe-in -76.09, 64.58 APE8-rot-na 29.06 APE67-dihe-in -60.28, -25.48 -61.59, -25.7 APE12-dist-na 16.9431 APE11-dist-na 19.6772 APE10-dist-na 15.0603 APE9-dist-out 9.421 K596R None None XRAY 1.48 0.17 0.186 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4hcv TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 9NWXA Q08881 355 618 620.0 A1B66:4000 Type1 Inactive DFGin 7.0866 14.5355 BLBplus -128.92, 168.77 57.89, 26.99 -62.43, 129.62 31.87, 100.98 73.72, 4.73 out-out out 15.9435 Saltbr-out 15.4765 HRD-in -66.64, -56.13 87.66, -20.54 out-out-out SNCooo out-out ActLoopNT-out 7.6895 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -97.5, 2.46 APE9-dihe-in -53.86, 133.69 APE8-dihe-in -76.74, 64.03 APE8-rot-na 28.62 APE67-dihe-in -59.97, -24.9 -61.8, -27.75 APE12-dist-na 16.8466 APE11-dist-na 19.5435 APE10-dist-na 14.9406 APE9-dist-out 9.2968 None None None XRAY 1.348 0.184 0.227 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 9nwx TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3T9TA Q08881 356 618 620.0 IAQ:800 Type1 Inactive DFGin 6.7735 14.4927 BLBplus -133.26, 163.33 70.92, 17.23 -63.25, 134.41 35.22, 94.25 75.64, -6.16 out-out out 15.5025 Saltbr-out 16.7219 HRD-in -68.16, -56.44 84.68, -16.41 out-out-out SNCooo out-out ActLoopNT-out 7.8141 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.86, 8.85 APE9-dihe-in -60.08, 134.03 APE8-dihe-in -74.04, 60.88 APE8-rot-na 28.49 APE67-dihe-in -58.96, -21.93 -61.99, -29.89 APE12-dist-na 16.9604 APE11-dist-na 19.4889 APE10-dist-na 14.939 APE9-dist-out 9.311 F435T,K596R None None XRAY 1.65 0.169 0.205 A 267.0 263.0 0 29 29 0 [[363, 614]] 1.0 3t9t TYR_ITK_HUMAN TYR 7.1e-93 316.6 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M0YA Q08881 356 618 620.0 M0Y:701,M0Y:702 Type1,Type3 Inactive DFGin 7.8448 15.1972 BLBplus -141.6, 166.36 66.71, 17.91 -60.27, 129.64 36.65, 94.41 76.5, -2.08 out-out out 17.5206 Saltbr-out 17.3459 HRD-in -68.25, -55.63 85.63, -18.96 out-out-out SNCooo out-out ActLoopNT-out 7.6921 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.74, 10.14 APE9-dihe-in -58.61, 129.15 APE8-dihe-in -74.56, 61.05 APE8-rot-na 30.11 APE67-dihe-in -55.76, -27.74 -52.48, -35.64 APE12-dist-na 17.1555 APE11-dist-na 19.7159 APE10-dist-na 15.1263 APE9-dist-out 9.5408 None None None XRAY 1.7 0.192 0.217 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m0y TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M14A Q08881 355 617 620.0 QWS:701,QWS:702 Type1,Type3 Inactive DFGin 7.9063 15.2874 BLBplus -141.1, 166.22 67.86, 19.32 -65.07, 134.16 34.41, 95.93 77.24, -4.46 out-out out 17.119 Saltbr-out 17.5438 HRD-in -68.27, -55.6 86.81, -23.8 out-out-out SNCooo out-out ActLoopNT-out 7.7132 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -108.71, 8.97 APE9-dihe-in -54.99, 130.24 APE8-dihe-in -74.83, 60.83 APE8-rot-na 30.11 APE67-dihe-in -59.81, -24.12 -58.43, -29.02 APE12-dist-na 16.7954 APE11-dist-na 19.5813 APE10-dist-na 14.8676 APE9-dist-out 9.4533 None None None XRAY 1.55 0.166 0.189 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m14 TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M12A Q08881 355 618 620.0 1YZ:701 Type3 Inactive DFGin 7.9005 15.2562 BLBplus -141.2, 169.8 60.4, 25.89 -67.61, 137.8 36.63, 92.49 68.92, 0.26 out-out out 17.1532 Saltbr-out 16.9245 HRD-in -66.63, -51.27 84.1, -22.7 out-out-out SNCooo out-out ActLoopNT-out 7.8599 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.29, 13.09 APE9-dihe-in -55.02, 125.4 APE8-dihe-in -69.29, 63.1 APE8-rot-na 28.21 APE67-dihe-in -55.35, -27.28 -53.96, -32.74 APE12-dist-na 16.7016 APE11-dist-na 19.3996 APE10-dist-na 14.9535 APE9-dist-out 9.2922 None None None XRAY 2.15 0.185 0.228 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m12 TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M13A Q08881 355 618 620.0 1E0:701 Type3 Inactive DFGin 7.937 15.2355 BLBplus -140.0, 164.92 66.92, 22.84 -65.43, 134.74 36.83, 90.87 73.53, -6.2 out-out out 17.2582 Saltbr-out 17.1518 HRD-in -67.22, -57.57 90.49, -24.24 out-out-out SNCooo out-out ActLoopNT-out 7.7952 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.18, 13.19 APE9-dihe-in -58.29, 129.4 APE8-dihe-in -71.46, 60.73 APE8-rot-na 27.96 APE67-dihe-in -58.06, -25.43 -56.35, -32.28 APE12-dist-na 16.6748 APE11-dist-na 19.4586 APE10-dist-na 14.9852 APE9-dist-out 9.2712 None None None XRAY 1.85 0.19 0.232 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m13 TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M15A Q08881 355 617 620.0 QWS:701,ADP:702 Type3,ATPlike Inactive DFGin 7.9386 15.2905 BLBplus -140.12, 163.53 73.68, 16.28 -64.43, 134.2 34.87, 95.02 79.06, -6.9 out-out out 17.0659 Saltbr-out 16.2542 HRD-in -70.42, -53.15 83.67, -22.02 out-out-out SNCooo out-out ActLoopNT-out 7.7398 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -106.59, 12.56 APE9-dihe-in -62.84, 135.73 APE8-dihe-in -75.4, 60.83 APE8-rot-na 30.68 APE67-dihe-in -61.26, -23.89 -55.9, -32.96 APE12-dist-na 16.8357 APE11-dist-na 19.5146 APE10-dist-na 14.7845 APE9-dist-out 9.1517 None None None XRAY 1.52 0.172 0.186 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m15 TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4M0ZA Q08881 355 618 620.0 M0Z:701,M0Z:702 Type3,Type1 Inactive DFGin 7.7918 15.2991 BLBplus -142.86, 167.57 62.03, 26.35 -68.09, 133.84 36.84, 88.89 77.71, -3.06 out-out out 17.1553 Saltbr-out 17.394 HRD-in -65.48, -57.72 91.47, -20.89 out-out-out SNCooo out-out ActLoopNT-out 7.7161 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -108.44, 14.81 APE9-dihe-in -58.51, 125.05 APE8-dihe-in -69.28, 61.45 APE8-rot-na 28.96 APE67-dihe-in -55.27, -26.74 -56.77, -32.39 APE12-dist-na 16.6055 APE11-dist-na 19.3372 APE10-dist-na 14.8798 APE9-dist-out 9.3566 None None None XRAY 2.0 0.167 0.221 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m0z TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3MIYA Q08881 357 619 620.0 B49:60001 Type1 Inactive DFGin 4.4986 14.3272 None -118.72, 169.24 51.5, 47.57 -103.74, 999.0 53.54, 86.2 999.0, 999.0 in-out in 9.8276 Saltbr-out 5.0446 HRD-in -71.62, -53.3 80.88, -14.93 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 84.04 APE8-rot-na 334.29 APE67-dihe-in -65.24, -21.92 -59.14, -28.73 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.67 0.208 0.234 A 266.0 237.0 26 29 10 19 [[363, 614]] 1.0 3miy TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3MJ1A Q08881 357 615 620.0 614:60001 Type1 Inactive DFGin 5.9676 13.3428 None -126.6, 166.8 59.09, 29.18 -76.15, 999.0 48.51, 86.56 999.0, 999.0 out-out out 13.5229 Saltbr-out 12.0653 HRD-in -66.18, -54.69 85.37, -19.01 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 57.56 APE8-rot-na 26.94 APE67-dihe-in -66.28, -13.64 -60.47, -30.84 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.72 0.238 0.264 A 266.0 226.0 33 29 10 19 [[363, 614]] 1.0 3mj1 TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PQNA Q08881 357 615 620.0 2W6:701 Type1 Inactive DFGin 5.2901 14.7453 None -102.53, 173.37 -57.89, 164.97 -164.74, 161.08 47.42, 91.82 137.98, 999.0 in-out in 9.105 Saltbr-out 4.4161 HRD-in -70.76, -53.31 78.34, -16.06 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 138.94 APE8-dihe-in -78.94, 66.59 APE8-rot-na 37.6 APE67-dihe-in -61.43, -23.35 -57.61, -35.06 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.9577 C477S,E614A,E617A None None XRAY 1.71 0.161 0.202 A 266.0 240.0 19 29 12 17 [[363, 614]] 1.0 4pqn TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4MF0B Q08881 357 619 620.0 29Z:701 Type1 Inactive DFGin 6.8221 14.6295 None -147.79, -179.99 59.06, 76.1 -152.71, 999.0 51.7, 89.28 999.0, 999.0 out-out out 13.6042 Saltbr-out 14.5985 HRD-in -57.08, -45.93 79.95, -24.32 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -2.72 APE8-rot-na 30.57 APE67-dihe-in -60.16, -25.12 -59.46, -35.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.215 0.268 B 266.0 237.0 26 29 10 19 [[363, 614]] 1.0 4mf0 TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPCA Q08881 357 619 620.0 2VW:60701 Type1 Inactive DFGin 7.2293 13.3321 None -135.89, 168.01 69.21, 69.58 -147.47, 999.0 49.13, 86.55 999.0, 999.0 out-out out 13.4252 Saltbr-out 11.899 HRD-in -71.06, -46.31 73.14, -9.54 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 76.1 APE8-rot-na 25.52 APE67-dihe-in -66.61, -24.14 -69.06, -21.12 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.95 0.215 0.257 A 266.0 232.0 31 29 10 19 [[363, 614]] 1.0 4ppc TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 4PPCB Q08881 357 619 620.0 2VW:60701 Type1 Inactive DFGin 6.5864 13.7199 None -127.88, 164.09 63.12, 56.47 -117.01, 999.0 50.83, 90.79 999.0, 999.0 out-out out 13.4584 Saltbr-out 10.2014 HRD-in -62.38, -51.21 79.16, -15.21 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 14.83 APE8-rot-na 22.06 APE67-dihe-in -58.68, -39.7 -66.95, -19.6 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.95 0.215 0.257 B 266.0 230.0 33 29 10 19 [[363, 614]] 1.0 4ppc TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3QGWB Q08881 358 616 620.0 L7A:1 Type1 Inactive DFGin 5.1023 13.9528 None -132.64, -179.26 57.93, 42.12 -120.25, 999.0 60.69, 93.21 999.0, 999.0 in-out in 9.0896 Saltbr-out 5.424 HRD-in -75.97, -46.45 75.23, -6.09 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 53.51 APE8-rot-na 37.77 APE67-dihe-in -72.69, -9.67 -54.86, -23.7 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.245 0.32 B 286.0 240.0 19 29 10 19 [[363, 614]] 1.0 3qgw TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SM2B Q08881 358 617 620.0 STU:621 Type1 Inactive DFGin 5.378 13.3785 None -126.46, -161.15 38.96, 42.72 -115.58, 999.0 63.86, 78.79 999.0, 999.0 out-out out 11.099 Saltbr-out 6.8051 HRD-out -89.1, 89.71 -64.14, 17.77 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 70.78 APE8-rot-na 24.5 APE67-dihe-in -53.23, -18.63 -53.68, -42.83 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.3 0.246 0.292 B 264.0 241.0 19 29 10 19 [[363, 614]] 1.0 1sm2 TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 1SNUB Q08881 358 617 620.0 STU:621 Type1 Inactive DFGin 5.3215 13.3612 None -135.24, -161.39 47.41, 33.44 -112.08, 999.0 66.07, 77.87 999.0, 999.0 out-out out 11.1179 Saltbr-out 7.4836 HRD-out -85.26, 96.7 -69.16, 21.34 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.67 APE8-rot-na 31.48 APE67-dihe-in -68.53, -31.16 -49.5, -27.81 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.5 0.262 0.295 B 264.0 241.0 19 29 10 19 [[363, 614]] 1.0 1snu TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3V5JB Q08881 357 620 620.0 0F2:60701 Type1 Inactive DFGin 4.4328 14.4384 None -124.07, 161.2 59.09, 58.27 -105.58, 999.0 45.39, 90.64 999.0, 999.0 out-none out 10.3469 Saltbr-none 999.0 HRD-out -89.74, 97.95 -71.99, -8.9 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 8.88 APE8-rot-na 21.22 APE67-dihe-in -67.81, -24.63 -68.6, -25.82 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.59 0.246 0.27 B 266.0 239.0 25 29 10 19 [[363, 614]] 1.0 3v5j TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK 3QGYB Q08881 357 616 620.0 L7O:60001 Type1 None DFGin 6.8482 14.0574 BLAminus -138.24, -166.58 61.2, 71.7 -99.64, 31.78 306.13, 96.16 -71.38, 20.95 in-in in 8.1909 Saltbr-in 2.8512 HRD-in -62.69, -53.89 75.14, -0.93 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.56 APE8-rot-na 999.0 APE67-dihe-in -67.28, -16.11 -66.33, -15.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.208 0.247 B 286.0 244.0 16 29 13 16 [[363, 614]] 1.0 3qgy TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK

TYR_ITK (Tyrosine-protein kinase ITK/TSK)

Total number of chains: 59
Active chains: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 25 42.4% 4RFMA
DFGin BLBplus 21 35.6% 9NWXA
DFGin None 10 16.9% 4PQNA
DFGin BLAminus 3 5.1% AF-Q08881-K1A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
ITK ITK_HUMAN AF-Q08881-K1A Q08881 355 620 620.0 No_ligand No_ligand Active DFGin 6.8214 13.9075 BLAminus -136.24, -175.79 55.48, 69.15 -84.68, 14.38 297.44, 87.73 -59.11, -31.45 in-in in 8.5169 Saltbr-in 2.6683 HRD-in -76.35, -40.21 67.29, -20.01 in-in-in SNCiii in-in ActLoopNT-in 2.9949 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.3, 148.47 APE9-dihe-in -144.93, 156.29 APE8-dihe-in -75.22, 86.83 APE8-rot-na 32.7 APE67-dihe-in -68.82, -16.14 -43.59, -41.61 APE12-dist-na 14.8323 APE11-dist-na 9.9539 APE10-dist-na 11.6241 APE9-dist-in 6.7433 None None None AF2 -1.0 1.0 1.0 A 266.0 266.0 0 29 29 0 [[363, 614]] 1.0 AF-Q08881-K1 Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN AF-Q08881-K3A Q08881 355 620 620.0 No_ligand No_ligand Active DFGin 6.5024 13.9854 BLAminus -144.79, -174.87 55.86, 66.43 -79.5, 8.16 297.06, 87.75 -59.87, -25.16 in-in in 9.038 Saltbr-in 2.7194 HRD-in -79.2, -42.03 68.19, -14.89 in-in-in SNCiii in-in ActLoopNT-in 2.8904 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -70.4, 141.24 APE9-dihe-in -149.38, 158.97 APE8-dihe-in -78.23, 79.46 APE8-rot-na 37.36 APE67-dihe-in -71.52, -13.15 -44.16, -41.92 APE12-dist-na 13.8458 APE11-dist-na 9.0808 APE10-dist-na 9.903 APE9-dist-in 5.7563 None None None AF2 -1.0 1.0 1.0 A 266.0 266.0 0 29 29 0 [[363, 614]] 1.0 AF-Q08881-K3 Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3MIYB Q08881 357 619 620.0 B49:60002 Type1 Inactive DFGin 4.594 14.3076 BLAplus -119.14, 168.78 58.23, 44.95 -107.27, 10.53 54.14, 85.29 -87.92, 999.0 in-out in 9.7941 Saltbr-out 4.8729 HRD-in -72.48, -51.01 80.11, -14.33 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 102.33 APE8-rot-na 353.07 APE67-dihe-in -63.42, -24.1 -64.07, -27.41 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.67 0.208 0.234 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 3miy Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4MF1A Q08881 357 619 620.0 29Y:60701 Type1 Inactive DFGin 4.2916 14.4868 BLAplus -128.58, 173.62 47.23, 44.4 -102.38, 27.38 55.51, 83.16 -123.42, 25.0 in-out in 9.9354 Saltbr-out 4.2678 HRD-in -68.56, -53.29 81.24, -14.67 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 79.97 APE8-rot-na 27.54 APE67-dihe-in -68.46, -18.99 -58.04, -26.43 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 2.113 0.177 0.229 A 266.0 241.0 22 29 12 17 [[363, 614]] 1.0 4mf1 Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4MF1B Q08881 357 619 620.0 29Y:60701 Type1 Inactive DFGin 4.7416 14.3428 BLAplus -124.99, 172.1 51.55, 46.86 -105.12, 12.48 45.0, 90.17 -92.77, -1.83 in-out in 9.8193 Saltbr-out 4.4817 HRD-in -69.32, -50.71 79.01, -15.78 out-out-out SNCooo out-out ActLoopNT-out 7.3257 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, -64.99 APE8-dihe-in -85.8, 80.1 APE8-rot-na 32.91 APE67-dihe-in -59.48, -20.2 -53.72, -34.91 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.7248 C477S,E614A,E617A None None XRAY 2.113 0.177 0.229 B 266.0 244.0 19 29 15 14 [[363, 614]] 1.0 4mf1 Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4RFMA Q08881 357 618 620.0 3P6:60701 Type1 Inactive DFGin 5.6956 14.6922 BLAplus -130.1, -172.88 61.29, 32.56 -100.81, 1.34 57.0, 90.97 -146.78, 171.8 out-out out 14.6304 Saltbr-out 14.9508 HRD-in -71.39, -57.57 80.34, -7.79 out-out-out SNCooo out-out ActLoopNT-out 10.9555 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 120.86 APE8-dihe-in -87.67, 76.64 APE8-rot-na 29.6 APE67-dihe-in -56.13, -18.2 -56.22, -35.15 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.6419 C477S,E614A,E617A None None XRAY 2.1 0.206 0.264 A 266.0 248.0 14 29 15 14 [[363, 614]] 1.0 4rfm Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4KIOA Q08881 357 619 620.0 G5K:60701 Type1 Inactive DFGin 4.3753 14.7019 BLAplus -118.58, 173.69 46.99, 49.02 -104.86, 13.72 51.45, 89.71 -108.9, 22.66 out-out out 10.2411 Saltbr-out 6.477 HRD-in -69.61, -55.38 85.37, -11.53 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 96.8 APE8-rot-na 340.24 APE67-dihe-in -69.13, -18.83 -56.58, -22.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 A 266.0 238.0 25 29 13 16 [[363, 614]] 1.0 4kio Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4KIOB Q08881 357 619 620.0 G5K:60701 Type1 Inactive DFGin 4.2952 14.7129 BLAplus -122.69, 175.7 46.04, 47.6 -101.28, 10.89 51.75, 87.37 -102.32, 15.74 out-out out 10.2531 Saltbr-out 5.7795 HRD-in -67.94, -55.39 83.83, -14.35 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 57.92 APE8-rot-na 30.1 APE67-dihe-in -63.89, -21.23 -61.05, -22.92 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 B 266.0 237.0 26 29 13 16 [[363, 614]] 1.0 4kio Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4KIOD Q08881 357 618 620.0 G6K:60701 Type1 Inactive DFGin 4.3176 14.943 BLAplus -116.62, 177.25 41.84, 49.19 -104.11, 15.35 56.06, 88.31 -106.43, 8.49 out-out out 10.4684 Saltbr-out 6.034 HRD-in -72.72, -56.36 82.16, -14.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 72.7 APE8-rot-na 32.65 APE67-dihe-in -60.87, -19.97 -56.03, -25.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.18 0.167 0.202 D 266.0 240.0 22 29 12 17 [[363, 614]] 1.0 4kio Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4L7SA Q08881 357 620 620.0 G7K:60701 Type1 Inactive DFGin 4.3212 14.4343 BLAplus -124.59, 171.94 51.32, 50.71 -109.92, 5.46 56.29, 89.14 -102.46, 17.01 in-out in 9.7402 Saltbr-out 5.3337 HRD-in -76.58, -50.89 82.84, -20.81 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 76.81 APE8-rot-na 357.82 APE67-dihe-in -66.8, -22.86 -59.01, -24.44 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.03 0.174 0.221 A 266.0 248.0 16 29 13 16 [[363, 614]] 1.0 4l7s Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4L7SB Q08881 357 620 620.0 G7K:60701 Type1 Inactive DFGin 4.1978 14.392 BLAplus -124.02, 169.18 48.34, 47.86 -102.54, 11.12 54.89, 92.04 -109.98, 19.4 in-out in 9.8607 Saltbr-out 5.1345 HRD-in -72.3, -56.34 84.23, -15.49 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 72.72 APE8-rot-na 1.37 APE67-dihe-in -61.64, -23.89 -56.78, -30.01 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.03 0.174 0.221 B 266.0 248.0 16 29 13 16 [[363, 614]] 1.0 4l7s Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4MF0A Q08881 357 619 620.0 29Z:701 Type1 Inactive DFGin 7.1006 14.4248 BLAplus -143.98, 170.19 56.85, 56.33 -101.39, -51.6 26.45, 98.65 -110.48, 47.98 out-out out 13.7182 Saltbr-out 14.166 HRD-in -56.64, -44.55 74.19, -20.92 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -32.27 APE8-rot-na 25.9 APE67-dihe-in -64.12, -28.5 -67.87, -25.3 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.215 0.268 A 266.0 240.0 23 29 13 16 [[363, 614]] 1.0 4mf0 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PP9A Q08881 357 619 620.0 2VT:60703 Type1 Inactive DFGin 4.5741 14.3768 BLAplus -129.82, 173.12 60.62, 46.22 -109.56, 65.21 50.22, 98.43 -109.57, 999.0 in-out in 9.6225 Saltbr-out 6.2278 HRD-in -69.9, -46.84 72.12, -13.05 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 46.87 APE8-rot-na 7.97 APE67-dihe-in -59.81, -20.4 -60.0, -37.67 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.58 0.226 0.284 A 266.0 245.0 18 29 11 18 [[363, 614]] 1.0 4pp9 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PP9B Q08881 357 619 620.0 2VT:60701 Type1 Inactive DFGin 4.7151 14.1683 BLAplus -138.23, 168.78 63.5, 44.16 -112.36, 32.92 51.03, 84.48 -116.59, 30.97 in-out in 9.7257 Saltbr-out 6.0652 HRD-in -67.7, -52.74 75.42, -11.53 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 0.48 APE8-rot-na 28.82 APE67-dihe-in -67.24, -9.86 -58.99, -34.05 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.58 0.226 0.284 B 266.0 246.0 17 29 12 17 [[363, 614]] 1.0 4pp9 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4QD6A Q08881 357 619 620.0 30T:60701 Type1 Inactive DFGin 6.5092 13.7336 BLAplus -132.38, -177.15 51.25, 38.99 -87.87, -18.58 45.6, 90.99 -54.76, -85.16 out-out out 12.6343 Saltbr-out 11.4229 HRD-in -64.17, -59.7 95.32, -29.76 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -33.01 APE8-rot-na 30.41 APE67-dihe-in -61.7, -24.35 -58.27, -31.76 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.45 0.212 0.267 A 266.0 242.0 21 29 13 16 [[363, 614]] 1.0 4qd6 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3QGWA Q08881 358 618 620.0 PQC:1 Type1 Inactive DFGin 4.9728 13.0876 BLAplus -131.51, -179.94 53.74, 33.71 -89.79, -22.03 54.92, 80.2 -84.37, 999.0 out-out out 11.5976 Saltbr-out 6.3948 HRD-in -92.02, -0.19 23.56, -1.23 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 169.21 APE8-dihe-in -72.23, 65.56 APE8-rot-na 339.97 APE67-dihe-in -68.71, -19.0 -63.58, -17.46 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.0205 None None None XRAY 2.1 0.245 0.32 A 286.0 244.0 17 29 12 17 [[363, 614]] 1.0 3qgw Homo sapiens TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3QGYA Q08881 357 618 620.0 PQC:60001 Type1 Inactive DFGin 4.7023 13.3978 BLAplus -130.17, 173.6 58.05, 28.5 -83.19, -21.92 53.94, 76.12 -98.05, 999.0 out-out out 10.7365 Saltbr-out 7.447 HRD-in -73.36, -56.75 77.34, -6.04 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.92 APE8-rot-na 332.56 APE67-dihe-in -71.07, -15.83 -62.67, -17.28 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.208 0.247 A 286.0 244.0 18 29 11 18 [[363, 614]] 1.0 3qgy Homo sapiens TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5JA Q08881 357 618 620.0 0F2:60701 Type1 Inactive DFGin 4.2713 14.4308 BLAplus -118.52, 160.44 57.13, 61.88 -107.71, -6.19 47.25, 95.66 -84.37, 999.0 out-none out 10.0149 Saltbr-none 999.0 HRD-out -87.3, 100.32 -72.15, -10.02 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 36.8 APE8-rot-na 22.05 APE67-dihe-in -63.51, -32.51 -68.68, -23.04 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.59 0.246 0.27 A 266.0 239.0 23 29 11 18 [[363, 614]] 1.0 3v5j Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5LA Q08881 357 616 620.0 0G1:60701 Type1 Inactive DFGin 4.1338 14.7047 BLAplus -115.85, 171.01 48.27, 46.07 -96.05, 11.31 58.96, 91.61 -107.31, 8.54 out-none out 10.1449 Saltbr-none 999.0 HRD-in -65.69, -47.42 74.14, -16.58 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 142.05 APE8-rot-na 332.57 APE67-dihe-in -62.15, -19.85 -69.15, -18.57 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 1.86 0.232 0.252 A 266.0 238.0 22 29 13 16 [[363, 614]] 1.0 3v5l Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5LB Q08881 357 619 620.0 0G1:60701 Type1 Inactive DFGin 4.1399 14.6499 BLAplus -115.25, 172.45 47.57, 47.21 -97.73, 8.05 59.86, 89.65 -107.55, 11.69 out-out out 10.0753 Saltbr-out 5.3889 HRD-in -66.97, -47.64 75.37, -19.95 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -28.51 APE8-rot-na 26.38 APE67-dihe-in -61.19, -18.82 -58.23, -34.87 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 1.86 0.232 0.252 B 266.0 239.0 24 29 13 16 [[363, 614]] 1.0 3v5l Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5LC Q08881 357 616 620.0 0G1:60701 Type1 Inactive DFGin 4.151 14.49 BLAplus -119.43, 171.57 47.86, 45.98 -95.4, 6.02 56.69, 90.24 -103.84, 4.9 in-out in 9.9164 Saltbr-out 5.4292 HRD-in -67.67, -52.97 78.54, -20.18 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 134.05 APE8-dihe-out -64.27, -25.66 APE8-rot-na 343.98 APE67-dihe-in -64.94, -21.62 -63.54, -24.83 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.2825 None None None XRAY 1.86 0.232 0.252 C 266.0 242.0 18 29 14 15 [[363, 614]] 1.0 3v5l Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5LD Q08881 357 619 620.0 0G1:60701 Type1 Inactive DFGin 4.1221 14.5366 BLAplus -118.73, 170.46 50.59, 44.65 -96.3, 5.17 58.81, 89.99 -103.3, 10.97 out-out out 10.0127 Saltbr-out 5.4138 HRD-in -69.59, -48.92 76.64, -24.59 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 84.06 APE8-dihe-out -96.47, -61.68 APE8-rot-na 21.65 APE67-dihe-in -60.91, -18.81 -64.24, -17.65 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.5568 None None None XRAY 1.86 0.232 0.252 D 266.0 244.0 19 29 13 16 [[363, 614]] 1.0 3v5l Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V8TA Q08881 357 618 620.0 477:60701 Type1 Inactive DFGin 4.2315 14.4642 BLAplus -118.95, 167.7 48.94, 50.18 -99.3, 5.63 54.69, 89.09 -99.94, 4.7 out-out out 10.0529 Saltbr-out 4.3112 HRD-in -68.26, -49.95 78.02, -22.27 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 178.92 APE8-rot-na 331.13 APE67-dihe-in -62.92, -38.74 -155.44, -29.56 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.0 0.221 0.248 A 266.0 236.0 26 29 12 17 [[363, 614]] 1.0 3v8t Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V8TB Q08881 357 619 620.0 477:60701 Type1 Inactive DFGin 4.2401 14.4304 BLAplus -118.41, 168.07 51.0, 46.57 -97.03, 4.16 57.29, 90.12 -98.81, 3.03 out-none out 10.0608 Saltbr-none 999.0 HRD-in -66.81, -51.51 78.21, -18.77 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 84.89 APE8-rot-na 330.19 APE67-dihe-in -61.4, -24.89 -59.94, -28.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.0 0.221 0.248 B 266.0 242.0 21 29 13 16 [[363, 614]] 1.0 3v8t Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V8WA Q08881 357 619 620.0 0G2:60701 Type1 Inactive DFGin 4.1401 14.4342 BLAplus -119.79, 170.29 59.08, 31.97 -85.94, -7.64 58.52, 91.96 -70.44, 999.0 out-none out 10.5013 Saltbr-none 999.0 HRD-in -68.04, -41.85 72.31, -23.68 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 79.4 APE8-rot-na 22.7 APE67-dihe-in -61.79, -33.9 -87.14, -15.62 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.27 0.252 0.268 A 266.0 241.0 22 29 11 18 [[363, 614]] 1.0 3v8w Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V8WB Q08881 357 619 620.0 0G2:60702 Type1 Inactive DFGin 4.2515 14.4975 BLAplus -115.32, 167.75 61.24, 31.37 -84.42, -9.7 58.09, 92.42 -87.94, 999.0 out-none out 10.6916 Saltbr-none 999.0 HRD-in -66.06, -47.99 75.65, -16.62 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 138.4 APE8-rot-na 24.46 APE67-dihe-in -62.86, -34.17 -86.74, -6.01 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.27 0.252 0.268 B 266.0 240.0 23 29 11 18 [[363, 614]] 1.0 3v8w Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4KIOC Q08881 357 620 620.0 G6K:60701,G5K:60702 Type1,Type1 Inactive DFGin 4.3958 14.6888 BLAplus -123.89, 178.68 54.44, 40.53 -101.16, 11.51 53.39, 88.01 -105.65, 3.86 out-out out 10.054 Saltbr-out 5.6585 HRD-in -74.91, -55.25 81.74, -10.36 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nnoai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 89.85 APE8-dihe-out -60.01, -29.11 APE8-rot-na 27.38 APE67-dihe-in -70.11, -21.52 -53.02, -24.29 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 11.2438 Y512E None None XRAY 2.18 0.167 0.202 C 266.0 249.0 15 29 14 15 [[363, 614]] 1.0 4kio Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SNXA Q08881 357 619 620.0 No_ligand No_ligand Inactive DFGin 5.3728 13.4608 BLBplus -148.45, -167.42 58.81, 12.72 -82.43, -172.25 53.12, 132.58 94.98, 999.0 out-out out 11.6603 Saltbr-out 7.1783 HRD-out -68.86, 105.83 -82.58, 39.73 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 26.12 APE8-rot-na 324.61 APE67-dihe-in -48.54, -49.15 -61.72, -27.92 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 3.2 0.271 0.296 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snx Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SNXB Q08881 357 619 620.0 No_ligand No_ligand Inactive DFGin 5.7953 13.105 BLBplus -168.37, -173.82 67.22, 2.08 -70.51, -158.27 49.86, 149.68 88.41, 999.0 out-out out 11.3392 Saltbr-out 7.4999 HRD-out -66.67, 86.47 -66.74, 48.69 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 46.42 APE8-rot-na 325.34 APE67-dihe-in -35.46, -58.25 -69.23, -38.36 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 3.2 0.271 0.296 B 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snx Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3MJ2A Q08881 357 615 620.0 MJG:1 Type1 Inactive DFGin 5.6353 14.566 BLBplus -129.73, 165.59 57.96, 29.14 -59.86, 130.89 36.54, 95.94 74.56, 1.89 out-out out 15.1105 Saltbr-out 16.1446 HRD-in -66.78, -53.43 86.15, -22.26 out-out-out SNCooo out-out ActLoopNT-out 7.7434 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -103.95, 8.69 APE9-dihe-in -65.75, 130.65 APE8-dihe-in -71.52, 63.99 APE8-rot-na 27.29 APE67-dihe-in -64.94, -20.79 -56.06, -33.73 APE12-dist-na 16.7617 APE11-dist-na 19.2905 APE10-dist-na 14.5721 APE9-dist-out 8.9381 C477S,E614A,E617A None None XRAY 1.9 0.208 0.252 A 266.0 259.0 0 29 29 0 [[363, 614]] 1.0 3mj2 Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPAA Q08881 357 619 620.0 2VU:60701 Type1 Inactive DFGin 6.408 13.5479 BLBplus -130.29, 170.67 58.49, 42.81 -95.59, 145.08 43.49, 93.78 142.48, 999.0 out-out out 12.5034 Saltbr-out 10.969 HRD-out -77.83, 144.82 -111.74, -5.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -44.5 APE8-rot-na 21.29 APE67-dihe-in -59.97, -32.38 -62.98, -33.05 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.237 0.278 A 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppa Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPAB Q08881 357 619 620.0 2VU:60701 Type1 Inactive DFGin 6.5195 13.6707 BLBplus -131.72, 177.67 58.91, 33.55 -89.94, 137.79 45.37, 86.14 178.27, 999.0 out-out out 12.9502 Saltbr-out 11.0848 HRD-out -90.04, 92.95 -68.76, 1.92 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -31.04 APE8-rot-na 27.17 APE67-dihe-in -62.28, -21.32 -65.84, -33.0 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.237 0.278 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppa Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPBA Q08881 357 619 620.0 2VV:60701 Type1 Inactive DFGin 6.8705 13.6353 BLBplus -134.69, 173.46 62.47, 48.87 -112.54, 114.52 48.77, 99.62 179.54, 999.0 out-out out 12.4379 Saltbr-out 10.5108 HRD-in -68.02, -57.27 82.05, -12.41 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -34.6 APE8-rot-na 25.65 APE67-dihe-in -49.89, -39.85 -57.53, -38.31 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.82 0.214 0.266 A 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppb Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPBB Q08881 357 619 620.0 2VV:60701 Type1 Inactive DFGin 6.8336 14.0088 BLBplus -138.14, 179.9 61.49, 31.68 -97.02, 135.52 54.08, 93.82 97.86, 999.0 out-out out 12.7993 Saltbr-out 12.2513 HRD-in -73.75, -53.09 75.89, -15.15 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -0.43 APE8-rot-na 27.03 APE67-dihe-in -53.1, -26.37 -54.4, -38.45 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.82 0.214 0.266 B 266.0 238.0 25 29 11 18 [[363, 614]] 1.0 4ppb Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4QD6B Q08881 357 619 620.0 30T:60701 Type1 Inactive DFGin 6.43 13.3454 BLBplus -124.32, 178.2 63.05, 48.97 -116.35, 143.6 42.38, 90.89 85.03, 100.78 out-out out 12.2584 Saltbr-out 7.6567 HRD-in -67.53, -57.21 95.66, -55.07 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 120.42 APE8-rot-na 334.31 APE67-dihe-in -66.95, -30.25 -76.29, -6.4 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.45 0.212 0.267 B 266.0 241.0 22 29 13 16 [[363, 614]] 1.0 4qd6 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SM2A Q08881 357 619 620.0 STU:301 Type1 Inactive DFGin 5.4974 13.3207 BLBplus -148.18, -157.96 48.2, 18.11 -92.5, -172.62 59.26, 91.5 71.27, 999.0 out-out out 10.5039 Saltbr-out 8.0102 HRD-out -81.72, 93.89 -66.35, 12.1 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 67.52 APE8-rot-na 340.44 APE67-dihe-in -77.92, -11.34 -60.73, -6.74 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.3 0.246 0.292 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1sm2 Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SNUA Q08881 357 619 620.0 STU:301 Type1 Inactive DFGin 5.4095 13.5857 BLBplus -121.03, -147.07 39.99, 19.77 -95.61, 161.03 65.42, 97.15 81.16, 999.0 out-out out 10.9852 Saltbr-out 7.7298 HRD-out -99.78, 92.32 -72.7, 37.05 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 62.98 APE8-rot-na 339.02 APE67-dihe-in -71.29, -26.27 -59.31, -15.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.5 0.262 0.295 A 264.0 245.0 18 29 11 18 [[363, 614]] 1.0 1snu Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4HCTA Q08881 354 618 620.0 18R:701 Type1 Inactive DFGin 6.557 15.146 BLBplus -128.45, 162.21 70.18, 18.36 -59.19, 130.98 39.81, 91.57 71.92, -1.6 out-out out 15.687 Saltbr-out 17.4566 HRD-in -67.59, -54.72 86.79, -22.97 out-out-out SNCooo out-out ActLoopNT-out 7.6703 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.04, 10.58 APE9-dihe-in -67.52, 136.72 APE8-dihe-in -78.72, 62.88 APE8-rot-na 32.19 APE67-dihe-in -57.37, -24.33 -56.88, -35.68 APE12-dist-na 17.2477 APE11-dist-na 19.4488 APE10-dist-na 14.6903 APE9-dist-out 8.9793 K596R None None XRAY 1.48 0.172 0.184 A 269.0 265.0 0 29 29 0 [[363, 614]] 1.0 4hct Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4HCUA Q08881 356 618 620.0 13L:701 Type1 Inactive DFGin 6.484 15.2164 BLBplus -122.04, 165.04 71.22, 16.71 -57.18, 130.79 39.32, 95.0 73.43, -2.82 out-out out 15.7902 Saltbr-out 17.9986 HRD-in -67.74, -56.29 87.8, -21.62 out-out-out SNCooo out-out ActLoopNT-out 7.8004 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.12, 8.58 APE9-dihe-in -67.8, 136.48 APE8-dihe-in -77.15, 62.05 APE8-rot-na 28.78 APE67-dihe-in -64.33, -16.67 -57.63, -35.53 APE12-dist-na 16.7816 APE11-dist-na 19.1772 APE10-dist-na 14.3901 APE9-dist-out 8.8665 K596R None None XRAY 1.43 0.17 0.191 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4hcu Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4HCVA Q08881 356 618 620.0 13J:701 Type1 Inactive DFGin 6.7055 14.9965 BLBplus -134.36, 168.09 71.48, 14.63 -58.41, 126.24 33.04, 92.99 79.45, -5.95 out-out out 15.7255 Saltbr-out 18.3258 HRD-in -68.44, -51.85 85.01, -27.11 out-out-out SNCooo out-out ActLoopNT-out 7.7591 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -114.1, 12.26 APE9-dihe-in -64.3, 132.51 APE8-dihe-in -76.09, 64.58 APE8-rot-na 29.06 APE67-dihe-in -60.28, -25.48 -61.59, -25.7 APE12-dist-na 16.9431 APE11-dist-na 19.6772 APE10-dist-na 15.0603 APE9-dist-out 9.421 K596R None None XRAY 1.48 0.17 0.186 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4hcv Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 9NWXA Q08881 355 618 620.0 A1B66:4000 Type1 Inactive DFGin 7.0866 14.5355 BLBplus -128.92, 168.77 57.89, 26.99 -62.43, 129.62 31.87, 100.98 73.72, 4.73 out-out out 15.9435 Saltbr-out 15.4765 HRD-in -66.64, -56.13 87.66, -20.54 out-out-out SNCooo out-out ActLoopNT-out 7.6895 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -97.5, 2.46 APE9-dihe-in -53.86, 133.69 APE8-dihe-in -76.74, 64.03 APE8-rot-na 28.62 APE67-dihe-in -59.97, -24.9 -61.8, -27.75 APE12-dist-na 16.8466 APE11-dist-na 19.5435 APE10-dist-na 14.9406 APE9-dist-out 9.2968 None None None XRAY 1.348 0.184 0.227 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 9nwx Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3T9TA Q08881 356 618 620.0 IAQ:800 Type1 Inactive DFGin 6.7735 14.4927 BLBplus -133.26, 163.33 70.92, 17.23 -63.25, 134.41 35.22, 94.25 75.64, -6.16 out-out out 15.5025 Saltbr-out 16.7219 HRD-in -68.16, -56.44 84.68, -16.41 out-out-out SNCooo out-out ActLoopNT-out 7.8141 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.86, 8.85 APE9-dihe-in -60.08, 134.03 APE8-dihe-in -74.04, 60.88 APE8-rot-na 28.49 APE67-dihe-in -58.96, -21.93 -61.99, -29.89 APE12-dist-na 16.9604 APE11-dist-na 19.4889 APE10-dist-na 14.939 APE9-dist-out 9.311 F435T,K596R None None XRAY 1.65 0.169 0.205 A 267.0 263.0 0 29 29 0 [[363, 614]] 1.0 3t9t Homo sapiens TYR_ITK_HUMAN TYR 7.1e-93 316.6 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M0YA Q08881 356 618 620.0 M0Y:701,M0Y:702 Type1,Type3 Inactive DFGin 7.8448 15.1972 BLBplus -141.6, 166.36 66.71, 17.91 -60.27, 129.64 36.65, 94.41 76.5, -2.08 out-out out 17.5206 Saltbr-out 17.3459 HRD-in -68.25, -55.63 85.63, -18.96 out-out-out SNCooo out-out ActLoopNT-out 7.6921 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.74, 10.14 APE9-dihe-in -58.61, 129.15 APE8-dihe-in -74.56, 61.05 APE8-rot-na 30.11 APE67-dihe-in -55.76, -27.74 -52.48, -35.64 APE12-dist-na 17.1555 APE11-dist-na 19.7159 APE10-dist-na 15.1263 APE9-dist-out 9.5408 None None None XRAY 1.7 0.192 0.217 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m0y Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M14A Q08881 355 617 620.0 QWS:701,QWS:702 Type1,Type3 Inactive DFGin 7.9063 15.2874 BLBplus -141.1, 166.22 67.86, 19.32 -65.07, 134.16 34.41, 95.93 77.24, -4.46 out-out out 17.119 Saltbr-out 17.5438 HRD-in -68.27, -55.6 86.81, -23.8 out-out-out SNCooo out-out ActLoopNT-out 7.7132 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -108.71, 8.97 APE9-dihe-in -54.99, 130.24 APE8-dihe-in -74.83, 60.83 APE8-rot-na 30.11 APE67-dihe-in -59.81, -24.12 -58.43, -29.02 APE12-dist-na 16.7954 APE11-dist-na 19.5813 APE10-dist-na 14.8676 APE9-dist-out 9.4533 None None None XRAY 1.55 0.166 0.189 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m14 Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M12A Q08881 355 618 620.0 1YZ:701 Type3 Inactive DFGin 7.9005 15.2562 BLBplus -141.2, 169.8 60.4, 25.89 -67.61, 137.8 36.63, 92.49 68.92, 0.26 out-out out 17.1532 Saltbr-out 16.9245 HRD-in -66.63, -51.27 84.1, -22.7 out-out-out SNCooo out-out ActLoopNT-out 7.8599 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.29, 13.09 APE9-dihe-in -55.02, 125.4 APE8-dihe-in -69.29, 63.1 APE8-rot-na 28.21 APE67-dihe-in -55.35, -27.28 -53.96, -32.74 APE12-dist-na 16.7016 APE11-dist-na 19.3996 APE10-dist-na 14.9535 APE9-dist-out 9.2922 None None None XRAY 2.15 0.185 0.228 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m12 Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M13A Q08881 355 618 620.0 1E0:701 Type3 Inactive DFGin 7.937 15.2355 BLBplus -140.0, 164.92 66.92, 22.84 -65.43, 134.74 36.83, 90.87 73.53, -6.2 out-out out 17.2582 Saltbr-out 17.1518 HRD-in -67.22, -57.57 90.49, -24.24 out-out-out SNCooo out-out ActLoopNT-out 7.7952 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -107.18, 13.19 APE9-dihe-in -58.29, 129.4 APE8-dihe-in -71.46, 60.73 APE8-rot-na 27.96 APE67-dihe-in -58.06, -25.43 -56.35, -32.28 APE12-dist-na 16.6748 APE11-dist-na 19.4586 APE10-dist-na 14.9852 APE9-dist-out 9.2712 None None None XRAY 1.85 0.19 0.232 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m13 Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M15A Q08881 355 617 620.0 QWS:701,ADP:702 Type3,ATPlike Inactive DFGin 7.9386 15.2905 BLBplus -140.12, 163.53 73.68, 16.28 -64.43, 134.2 34.87, 95.02 79.06, -6.9 out-out out 17.0659 Saltbr-out 16.2542 HRD-in -70.42, -53.15 83.67, -22.02 out-out-out SNCooo out-out ActLoopNT-out 7.7398 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -106.59, 12.56 APE9-dihe-in -62.84, 135.73 APE8-dihe-in -75.4, 60.83 APE8-rot-na 30.68 APE67-dihe-in -61.26, -23.89 -55.9, -32.96 APE12-dist-na 16.8357 APE11-dist-na 19.5146 APE10-dist-na 14.7845 APE9-dist-out 9.1517 None None None XRAY 1.52 0.172 0.186 A 269.0 263.0 0 29 29 0 [[363, 614]] 1.0 4m15 Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4M0ZA Q08881 355 618 620.0 M0Z:701,M0Z:702 Type3,Type1 Inactive DFGin 7.7918 15.2991 BLBplus -142.86, 167.57 62.03, 26.35 -68.09, 133.84 36.84, 88.89 77.71, -3.06 out-out out 17.1553 Saltbr-out 17.394 HRD-in -65.48, -57.72 91.47, -20.89 out-out-out SNCooo out-out ActLoopNT-out 7.7161 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -108.44, 14.81 APE9-dihe-in -58.51, 125.05 APE8-dihe-in -69.28, 61.45 APE8-rot-na 28.96 APE67-dihe-in -55.27, -26.74 -56.77, -32.39 APE12-dist-na 16.6055 APE11-dist-na 19.3372 APE10-dist-na 14.8798 APE9-dist-out 9.3566 None None None XRAY 2.0 0.167 0.221 A 269.0 264.0 0 29 29 0 [[363, 614]] 1.0 4m0z Homo sapiens TYR_ITK_HUMAN TYR 1.2e-92 315.8 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3MIYA Q08881 357 619 620.0 B49:60001 Type1 Inactive DFGin 4.4986 14.3272 None -118.72, 169.24 51.5, 47.57 -103.74, 999.0 53.54, 86.2 999.0, 999.0 in-out in 9.8276 Saltbr-out 5.0446 HRD-in -71.62, -53.3 80.88, -14.93 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 84.04 APE8-rot-na 334.29 APE67-dihe-in -65.24, -21.92 -59.14, -28.73 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.67 0.208 0.234 A 266.0 237.0 26 29 10 19 [[363, 614]] 1.0 3miy Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3MJ1A Q08881 357 615 620.0 614:60001 Type1 Inactive DFGin 5.9676 13.3428 None -126.6, 166.8 59.09, 29.18 -76.15, 999.0 48.51, 86.56 999.0, 999.0 out-out out 13.5229 Saltbr-out 12.0653 HRD-in -66.18, -54.69 85.37, -19.01 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 57.56 APE8-rot-na 26.94 APE67-dihe-in -66.28, -13.64 -60.47, -30.84 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 C477S,E614A,E617A None None XRAY 1.72 0.238 0.264 A 266.0 226.0 33 29 10 19 [[363, 614]] 1.0 3mj1 Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PQNA Q08881 357 615 620.0 2W6:701 Type1 Inactive DFGin 5.2901 14.7453 None -102.53, 173.37 -57.89, 164.97 -164.74, 161.08 47.42, 91.82 137.98, 999.0 in-out in 9.105 Saltbr-out 4.4161 HRD-in -70.76, -53.31 78.34, -16.06 out-none-out SNCono none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 138.94 APE8-dihe-in -78.94, 66.59 APE8-rot-na 37.6 APE67-dihe-in -61.43, -23.35 -57.61, -35.06 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.9577 C477S,E614A,E617A None None XRAY 1.71 0.161 0.202 A 266.0 240.0 19 29 12 17 [[363, 614]] 1.0 4pqn Homo sapiens TYR_ITK_HUMAN TYR 5e-93 317.1 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4MF0B Q08881 357 619 620.0 29Z:701 Type1 Inactive DFGin 6.8221 14.6295 None -147.79, -179.99 59.06, 76.1 -152.71, 999.0 51.7, 89.28 999.0, 999.0 out-out out 13.6042 Saltbr-out 14.5985 HRD-in -57.08, -45.93 79.95, -24.32 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, -2.72 APE8-rot-na 30.57 APE67-dihe-in -60.16, -25.12 -59.46, -35.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.67 0.215 0.268 B 266.0 237.0 26 29 10 19 [[363, 614]] 1.0 4mf0 Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPCA Q08881 357 619 620.0 2VW:60701 Type1 Inactive DFGin 7.2293 13.3321 None -135.89, 168.01 69.21, 69.58 -147.47, 999.0 49.13, 86.55 999.0, 999.0 out-out out 13.4252 Saltbr-out 11.899 HRD-in -71.06, -46.31 73.14, -9.54 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 76.1 APE8-rot-na 25.52 APE67-dihe-in -66.61, -24.14 -69.06, -21.12 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.95 0.215 0.257 A 266.0 232.0 31 29 10 19 [[363, 614]] 1.0 4ppc Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 4PPCB Q08881 357 619 620.0 2VW:60701 Type1 Inactive DFGin 6.5864 13.7199 None -127.88, 164.09 63.12, 56.47 -117.01, 999.0 50.83, 90.79 999.0, 999.0 out-out out 13.4584 Saltbr-out 10.2014 HRD-in -62.38, -51.21 79.16, -15.21 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 14.83 APE8-rot-na 22.06 APE67-dihe-in -58.68, -39.7 -66.95, -19.6 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 Y512E None None XRAY 2.95 0.215 0.257 B 266.0 230.0 33 29 10 19 [[363, 614]] 1.0 4ppc Homo sapiens TYR_ITK_HUMAN TYR 2.1e-92 315.0 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3QGWB Q08881 358 616 620.0 L7A:1 Type1 Inactive DFGin 5.1023 13.9528 None -132.64, -179.26 57.93, 42.12 -120.25, 999.0 60.69, 93.21 999.0, 999.0 in-out in 9.0896 Saltbr-out 5.424 HRD-in -75.97, -46.45 75.23, -6.09 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 53.51 APE8-rot-na 37.77 APE67-dihe-in -72.69, -9.67 -54.86, -23.7 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.245 0.32 B 286.0 240.0 19 29 10 19 [[363, 614]] 1.0 3qgw Homo sapiens TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SM2B Q08881 358 617 620.0 STU:621 Type1 Inactive DFGin 5.378 13.3785 None -126.46, -161.15 38.96, 42.72 -115.58, 999.0 63.86, 78.79 999.0, 999.0 out-out out 11.099 Saltbr-out 6.8051 HRD-out -89.1, 89.71 -64.14, 17.77 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 70.78 APE8-rot-na 24.5 APE67-dihe-in -53.23, -18.63 -53.68, -42.83 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.3 0.246 0.292 B 264.0 241.0 19 29 10 19 [[363, 614]] 1.0 1sm2 Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 1SNUB Q08881 358 617 620.0 STU:621 Type1 Inactive DFGin 5.3215 13.3612 None -135.24, -161.39 47.41, 33.44 -112.08, 999.0 66.07, 77.87 999.0, 999.0 out-out out 11.1179 Saltbr-out 7.4836 HRD-out -85.26, 96.7 -69.16, 21.34 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.67 APE8-rot-na 31.48 APE67-dihe-in -68.53, -31.16 -49.5, -27.81 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.5 0.262 0.295 B 264.0 241.0 19 29 10 19 [[363, 614]] 1.0 1snu Homo sapiens TYR_ITK_HUMAN TYR 9.2e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3V5JB Q08881 357 620 620.0 0F2:60701 Type1 Inactive DFGin 4.4328 14.4384 None -124.07, 161.2 59.09, 58.27 -105.58, 999.0 45.39, 90.64 999.0, 999.0 out-none out 10.3469 Saltbr-none 999.0 HRD-out -89.74, 97.95 -71.99, -8.9 none-none-none SNCnnn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 8.88 APE8-rot-na 21.22 APE67-dihe-in -67.81, -24.63 -68.6, -25.82 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.59 0.246 0.27 B 266.0 239.0 25 29 10 19 [[363, 614]] 1.0 3v5j Homo sapiens TYR_ITK_HUMAN TYR 9.4e-93 316.2 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK
ITK ITK_HUMAN 3QGYB Q08881 357 616 620.0 L7O:60001 Type1 None DFGin 6.8482 14.0574 BLAminus -138.24, -166.58 61.2, 71.7 -99.64, 31.78 306.13, 96.16 -71.38, 20.95 in-in in 8.1909 Saltbr-in 2.8512 HRD-in -62.69, -53.89 75.14, -0.93 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nnnai APEdist_aaan APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 999.0 APE8-dihe-none 999.0, 61.56 APE8-rot-na 999.0 APE67-dihe-in -67.28, -16.11 -66.33, -15.23 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-none 999.0 None None None XRAY 2.1 0.208 0.247 B 286.0 244.0 16 29 13 16 [[363, 614]] 1.0 3qgy Homo sapiens TYR_ITK_HUMAN TYR 1.3e-92 315.7 1.0 260.0 260.0 499 500 501 503 505 391 406 410 479 481 480 482.0 540 528 523 522 521 520 519 518 517 436 Tyrosine-protein kinase ITK/TSK

TYR_ITK (Tyrosine-protein kinase ITK/TSK)

Total number of chains: 0
Active chains: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name