Ligand: BI1

Total number of chains: 5
Active chains: 4
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 100.0% 1XWSA
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.

Group 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 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
AGC PDPK1 PDPK1_HUMAN 1UU8A O15530 72 358 556.0 BI1:1368 Type1 Inactive DFGin 6.6469 14.4714 BLAminus -136.37, -165.37 63.01, 71.98 -101.9, 2.54 288.65, 101.81 -58.08, -33.97 in-in in 8.8152 Saltbr-in 2.7275 HRD-in -71.97, -53.07 75.47, 11.05 in-in-out SNCiio in-out ActLoopNT-in 2.8428 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -142.67, 117.85 APE9-dihe-na -65.71, -160.29 APE8-dihe-in -63.31, 129.15 APE8-rot-in 297.13 APE67-dihe-in -68.38, -3.88 -40.88, -48.91 APE12-dist-in 9.2375 APE11-dist-out 5.6529 APE10-dist-out 10.0877 APE9-dist-in 3.759 None SEP241 SEP241 XRAY 2.5 0.176 0.258 A 310.0 279.0 8 30 22 8 [[82, 342]] 1.0 1uu8 AGC_PDPK1_HUMAN AGC 1.3e-84 289.3 1.0 260.0 260.0 222 223 224 226 228 111 130 134 202 204 203 205.0 264 252 247 246 245 244 243 242 241 160 3-phosphoinositide-dependent protein kinase 1
AGC PRKCI KPCI_HUMAN 1ZRZA P41743 249 588 596.0 BI1:61000 Type1 Active DFGin 5.4066 12.5714 BLAminus -130.8, 174.67 64.45, 118.73 -128.08, 29.21 300.88, 154.48 -95.06, 36.97 in-in in 8.489 Saltbr-in 2.7733 HRD-in -48.25, -53.67 63.34, -15.36 in-in-in SNCiii in-in ActLoopNT-in 2.9907 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -163.12, -165.87 APE9-dihe-na 92.97, 155.51 APE8-dihe-in -67.22, 110.52 APE8-rot-in 321.88 APE67-dihe-in -51.87, -24.47 -26.14, -57.0 APE12-dist-in 8.3992 APE11-dist-in 11.8236 APE10-dist-in 6.4557 APE9-dist-in 3.7889 None TPO412,TPO564 TPO412,TPO564 XRAY 3.0 0.249 0.333 A 364.0 312.0 9 28 28 0 [[254, 522]] 1.0 1zrz AGC_PRKCI_HUMAN AGC 2.4e-95 324.5 1.0 260.0 260.0 395 396 397 399 401 283 302 306 375 377 376 378.0 435 423 418 417 416 415 414 413 412 333 Protein kinase C iota type
CAMK PIM1 PIM1_HUMAN 1XWSA P11309 33 305 313.0 BI1:1001 Type1 Active DFGin 6.1159 14.9341 BLAminus -129.52, 166.95 66.18, 81.14 -88.91, 13.45 284.44, 80.6 -63.86, -15.19 in-in in 8.8578 Saltbr-in 2.8112 HRD-naA -69.66, -47.71 69.42, 1.43 in-in-in SNCiii in-in ActLoopNT-in 2.84 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.43, 26.37 APE9-dihe-na -77.62, -162.66 APE8-dihe-in -79.83, 125.2 APE8-rot-in 307.07 APE67-dihe-in -74.93, -11.45 -55.08, -43.34 APE12-dist-in 9.7063 APE11-dist-in 8.7658 APE10-dist-in 5.8681 APE9-dist-in 3.8449 None None None XRAY 1.8 0.182 0.213 A 313.0 273.0 0 26 26 0 [[38, 290]] 1.0 1xws CAMK_PIM1_HUMAN CAMK 4e-65 225.6 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CAMK PIM1 PIM1_HUMAN 2BIKB P11309 33 305 313.0 BI1:1306 Type1 Active DFGin 6.2085 14.8544 BLAminus -129.68, 166.2 65.31, 82.3 -90.49, 20.51 284.24, 80.72 -71.93, -11.81 in-in in 8.7316 Saltbr-in 2.7718 HRD-naA -71.08, -48.28 72.24, 3.48 in-in-in SNCiii in-in ActLoopNT-in 2.8318 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -125.84, 26.95 APE9-dihe-na -83.77, -163.0 APE8-dihe-in -86.27, 123.71 APE8-rot-in 311.31 APE67-dihe-in -70.32, -9.34 -58.19, -44.58 APE12-dist-in 9.5525 APE11-dist-in 8.6863 APE10-dist-in 5.6274 APE9-dist-in 3.928 None SEP261 SEP261 XRAY 1.8 0.159 0.183 B 313.0 273.0 0 26 26 0 [[38, 290]] 1.0 2bik CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CAMK PIM1 PIM1_HUMAN 2BILB P11309 33 306 313.0 BI1:1307 Type1 Active DFGin 5.907 14.6412 BLAminus -131.58, 166.0 69.48, 82.95 -91.3, 19.54 286.18, 78.18 -74.97, -10.91 in-in in 8.7854 Saltbr-in 2.6353 HRD-naA -70.92, -50.11 73.56, 6.45 in-in-in SNCiii in-in ActLoopNT-in 2.8565 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -155.49, 48.23 APE9-dihe-na -87.89, -146.11 APE8-dihe-in -91.43, 121.08 APE8-rot-in 306.95 APE67-dihe-in -71.1, -13.65 -55.02, -40.77 APE12-dist-in 9.4619 APE11-dist-in 8.2518 APE10-dist-in 6.34 APE9-dist-in 3.8583 None None None XRAY 2.55 0.195 0.248 B 313.0 274.0 0 26 26 0 [[38, 290]] 1.0 2bil CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1

Ligand: BI1

Total number of chains: 6
Active chains: 4
Total number of genes: 4
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 83.3% 1XWSA
DFGin BLBplus 1 16.7% 9EJXA
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.

Group 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
AGC PDPK1 PDPK1_HUMAN 1UU8A O15530 72 358 556.0 BI1:1368 Type1 Inactive DFGin 6.6469 14.4714 BLAminus -136.37, -165.37 63.01, 71.98 -101.9, 2.54 288.65, 101.81 -58.08, -33.97 in-in in 8.8152 Saltbr-in 2.7275 HRD-in -71.97, -53.07 75.47, 11.05 in-in-out SNCiio in-out ActLoopNT-in 2.8428 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -142.67, 117.85 APE9-dihe-na -65.71, -160.29 APE8-dihe-in -63.31, 129.15 APE8-rot-in 297.13 APE67-dihe-in -68.38, -3.88 -40.88, -48.91 APE12-dist-in 9.2375 APE11-dist-out 5.6529 APE10-dist-out 10.0877 APE9-dist-in 3.759 None SEP241 SEP241 XRAY 2.5 0.176 0.258 A 310.0 279.0 8 30 22 8 [[82, 342]] 1.0 1uu8 Homo sapiens AGC_PDPK1_HUMAN AGC 1.3e-84 289.3 1.0 260.0 260.0 222 223 224 226 228 111 130 134 202 204 203 205.0 264 252 247 246 245 244 243 242 241 160 3-phosphoinositide-dependent protein kinase 1
AGC PRKCI KPCI_HUMAN 1ZRZA P41743 249 588 596.0 BI1:61000 Type1 Active DFGin 5.4066 12.5714 BLAminus -130.8, 174.67 64.45, 118.73 -128.08, 29.21 300.88, 154.48 -95.06, 36.97 in-in in 8.489 Saltbr-in 2.7733 HRD-in -48.25, -53.67 63.34, -15.36 in-in-in SNCiii in-in ActLoopNT-in 2.9907 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -163.12, -165.87 APE9-dihe-na 92.97, 155.51 APE8-dihe-in -67.22, 110.52 APE8-rot-in 321.88 APE67-dihe-in -51.87, -24.47 -26.14, -57.0 APE12-dist-in 8.3992 APE11-dist-in 11.8236 APE10-dist-in 6.4557 APE9-dist-in 3.7889 None TPO412,TPO564 TPO412,TPO564 XRAY 3.0 0.249 0.333 A 364.0 312.0 9 28 28 0 [[254, 522]] 1.0 1zrz Homo sapiens AGC_PRKCI_HUMAN AGC 2.4e-95 324.5 1.0 260.0 260.0 395 396 397 399 401 283 302 306 375 377 376 378.0 435 423 418 417 416 415 414 413 412 333 Protein kinase C iota type
CAMK PIM1 PIM1_HUMAN 1XWSA P11309 33 305 313.0 BI1:1001 Type1 Active DFGin 6.1159 14.9341 BLAminus -129.52, 166.95 66.18, 81.14 -88.91, 13.45 284.44, 80.6 -63.86, -15.19 in-in in 8.8578 Saltbr-in 2.8112 HRD-naA -69.66, -47.71 69.42, 1.43 in-in-in SNCiii in-in ActLoopNT-in 2.84 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.43, 26.37 APE9-dihe-na -77.62, -162.66 APE8-dihe-in -79.83, 125.2 APE8-rot-in 307.07 APE67-dihe-in -74.93, -11.45 -55.08, -43.34 APE12-dist-in 9.7063 APE11-dist-in 8.7658 APE10-dist-in 5.8681 APE9-dist-in 3.8449 None None None XRAY 1.8 0.182 0.213 A 313.0 273.0 0 26 26 0 [[38, 290]] 1.0 1xws Homo sapiens CAMK_PIM1_HUMAN CAMK 4e-65 225.6 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CAMK PIM1 PIM1_HUMAN 2BIKB P11309 33 305 313.0 BI1:1306 Type1 Active DFGin 6.2085 14.8544 BLAminus -129.68, 166.2 65.31, 82.3 -90.49, 20.51 284.24, 80.72 -71.93, -11.81 in-in in 8.7316 Saltbr-in 2.7718 HRD-naA -71.08, -48.28 72.24, 3.48 in-in-in SNCiii in-in ActLoopNT-in 2.8318 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -125.84, 26.95 APE9-dihe-na -83.77, -163.0 APE8-dihe-in -86.27, 123.71 APE8-rot-in 311.31 APE67-dihe-in -70.32, -9.34 -58.19, -44.58 APE12-dist-in 9.5525 APE11-dist-in 8.6863 APE10-dist-in 5.6274 APE9-dist-in 3.928 None SEP261 SEP261 XRAY 1.8 0.159 0.183 B 313.0 273.0 0 26 26 0 [[38, 290]] 1.0 2bik Homo sapiens CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CAMK PIM1 PIM1_HUMAN 2BILB P11309 33 306 313.0 BI1:1307 Type1 Active DFGin 5.907 14.6412 BLAminus -131.58, 166.0 69.48, 82.95 -91.3, 19.54 286.18, 78.18 -74.97, -10.91 in-in in 8.7854 Saltbr-in 2.6353 HRD-naA -70.92, -50.11 73.56, 6.45 in-in-in SNCiii in-in ActLoopNT-in 2.8565 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -155.49, 48.23 APE9-dihe-na -87.89, -146.11 APE8-dihe-in -91.43, 121.08 APE8-rot-in 306.95 APE67-dihe-in -71.1, -13.65 -55.02, -40.77 APE12-dist-in 9.4619 APE11-dist-in 8.2518 APE10-dist-in 6.34 APE9-dist-in 3.8583 None None None XRAY 2.55 0.195 0.248 B 313.0 274.0 0 26 26 0 [[38, 290]] 1.0 2bil Homo sapiens CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
TYR BTK BTK_MOUSE 9EJXA P35991 396 659 659.0 A1BI1:60701 Type1.5_Back Inactive DFGin 5.364 13.4534 BLBplus -153.42, 172.61 57.75, 36.77 -82.82, 135.54 38.01, 92.52 69.8, 4.91 out-none out 14.6653 Saltbr-none 999.0 HRD-in -84.35, -55.61 84.23, -7.11 none-out-out SNCnoo out-out ActLoopNT-out 7.5531 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -111.32, 5.81 APE9-dihe-in -72.43, 137.34 APE8-dihe-in -77.97, 68.28 APE8-rot-na 30.72 APE67-dihe-in -70.58, -7.72 -58.08, -35.85 APE12-dist-na 16.4456 APE11-dist-na 18.506 APE10-dist-na 13.7176 APE9-dist-out 8.5004 K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P None None XRAY 2.86 0.264 0.296 A 271.0 264.0 0 29 29 0 [[402, 653]] 1.0 9ejx Mus musculus TYR_BTK_MOUSE TYR 1.1e-92 316.0 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK

Ligand: BI1

Total number of chains: 1
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 1 100.0% 9EJXA
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.

Group 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
TYR BTK BTK_MOUSE 9EJXA P35991 396 659 659.0 A1BI1:60701 Type1.5_Back Inactive DFGin 5.364 13.4534 BLBplus -153.42, 172.61 57.75, 36.77 -82.82, 135.54 38.01, 92.52 69.8, 4.91 out-none out 14.6653 Saltbr-none 999.0 HRD-in -84.35, -55.61 84.23, -7.11 none-out-out SNCnoo out-out ActLoopNT-out 7.5531 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out -111.32, 5.81 APE9-dihe-in -72.43, 137.34 APE8-dihe-in -77.97, 68.28 APE8-rot-na 30.72 APE67-dihe-in -70.58, -7.72 -58.08, -35.85 APE12-dist-na 16.4456 APE11-dist-na 18.506 APE10-dist-na 13.7176 APE9-dist-out 8.5004 K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P None None XRAY 2.86 0.264 0.296 A 271.0 264.0 0 29 29 0 [[402, 653]] 1.0 9ejx Mus musculus TYR_BTK_MOUSE TYR 1.1e-92 316.0 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK