Ligand: ZZL

Total number of chains: 7
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 4 57.1% 2WTVA
DFGin ABAminus 1 14.3% 2WTWA
DFGin None 1 14.3% 5IA1A
None None 1 14.3% 2X81A
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
CAMK AURKA AURKA_HUMAN 2WTWA O14965 128 389 403.0 ZZL:1390 Type1 Inactive DFGin 5.029 15.53 ABAminus -106.44, -45.36 -104.13, 150.11 -135.47, 26.63 287.92, 83.14 -51.9, -25.54 out-out out 11.468 Saltbr-out 6.023 HRD-in -69.03, -60.65 76.28, -17.41 out-in-out SNCoio in-out ActLoopNT-in 2.867 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnoo APE10-dihe-na 999.0, 10.4 APE9-dihe-na -133.69, -108.65 APE8-dihe-in -91.45, 126.3 APE8-rot-in 315.62 APE67-dihe-in -56.65, -42.97 -87.39, -8.96 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 10.643 APE9-dist-out 10.37 L215R,T217E,R220K None None XRAY 3.302 0.236 0.288 A 285 256 6 0 0 6 [[133, 383]] 1.0 2wtw CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVA O14965 125 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.701 9.454 None -75.22, 156.08 -105.21, 156.98 57.55, 45.32 319.02, 110.91 -59.58, -21.68 out-out out 12.224 Saltbr-out 9.738 HRD-out 56.62, 39.51 -65.34, 136.35 out-out-out SNCooo out-out ActLoopNT-out 17.312 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iioo APE10-dihe-na -58.52, -47.8 APE9-dihe-na -54.18, -45.12 APE8-dihe-out -70.51, -43.3 APE8-rot-in 297.14 APE67-dihe-in -48.3, -25.92 -57.93, -45.43 APE12-dist-in 8.287 APE11-dist-in 12.32 APE10-dist-out 15.039 APE9-dist-out 12.589 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 A 285 265 0 0 0 0 [[133, 383]] 1.0 2wtv CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVB O14965 126 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.619 9.422 None -74.68, 158.58 -101.8, 146.26 63.97, 49.3 317.28, 114.07 -55.55, -26.4 out-out out 12.419 Saltbr-out 10.297 HRD-out -138.44, 123.91 -119.97, 134.75 out-out-out SNCooo out-out ActLoopNT-out 19.511 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na 85.02, 1.5 APE9-dihe-na 116.84, -135.44 APE8-dihe-in -82.25, 112.82 APE8-rot-in 306.92 APE67-dihe-in -64.29, -12.84 -49.83, -55.07 APE12-dist-out 14.754 APE11-dist-out 14.75 APE10-dist-out 12.235 APE9-dist-out 12.287 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 B 285 264 0 0 0 0 [[133, 383]] 1.0 2wtv CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVC O14965 126 389 403.0 ZZL:1392 Type1 Inactive DFGinter 5.656 9.361 None -73.47, 155.34 -96.85, 146.28 67.08, 43.87 316.19, 116.1 -46.77, -31.93 out-out out 12.389 Saltbr-out 10.306 HRD-out -138.88, 125.11 -124.14, 137.81 out-out-out SNCooo out-out ActLoopNT-out 19.519 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na 85.46, 1.21 APE9-dihe-na 119.13, -135.87 APE8-dihe-in -82.97, 108.09 APE8-rot-in 299.33 APE67-dihe-in -62.27, -12.5 -42.96, -58.15 APE12-dist-out 14.766 APE11-dist-out 14.728 APE10-dist-out 12.267 APE9-dist-out 12.403 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 C 285 264 0 0 0 0 [[133, 383]] 1.0 2wtv CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVD O14965 125 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.688 9.447 None -74.49, 159.41 -108.43, 161.13 55.07, 43.29 317.21, 115.65 -58.54, -27.22 out-out out 12.194 Saltbr-out 9.796 HRD-out 49.31, 42.91 -68.48, 131.43 out-out-out SNCooo out-out ActLoopNT-out 17.059 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iioo APE10-dihe-na -57.61, -41.18 APE9-dihe-na -56.01, -51.32 APE8-dihe-out -76.54, -36.16 APE8-rot-out 70.56 APE67-dihe-in -47.19, -33.07 -56.26, -46.95 APE12-dist-in 8.314 APE11-dist-in 12.48 APE10-dist-out 15.096 APE9-dist-out 12.493 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 D 285 265 0 0 0 0 [[133, 383]] 1.0 2wtv CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2X81A O14965 127 388 403.0 ZZL:1389 Type1 Inactive None 999.0 999.0 None -101.61, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 out-none out 11.657 Saltbr-none 999.0 HRD-in -75.09, -52.06 78.45, -27.83 none-none-out SNCnno none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -158.98 APE8-dihe-in -83.83, 140.8 APE8-rot-out 188.92 APE67-dihe-in -38.04, -33.42 -91.87, -17.9 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 11.297 None None None XRAY 2.91 0.247 0.303 A 272 242 20 0 0 17 [[133, 383]] 1.0 2x81 CAMK_AURKA_HUMAN CAMK 6.4e-80 274.1 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
TYR EPHA2 EPHA2_HUMAN 5IA1A P29317 605 888 976.0 ZZL:1001 Type1 Inactive DFGin 5.104 13.44 None -130.45, -159.4 76.21, -65.85 93.22, -3.68 287.63, 98.57 73.71, -159.39 in-in in 8.825 Saltbr-in 3.231 HRD-in -77.12, -51.78 78.89, -19.53 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 94.06 APE8-dihe-in -70.6, 101.8 APE8-rot-na 29.53 APE67-dihe-in -68.76, -14.33 -55.26, -45.36 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 5.783 None None None XRAY 2.036 0.183 0.223 A 306 261 23 0 0 17 [[613, 873]] 1.0 5ia1 TYR_EPHA2_HUMAN TYR 5.5e-108 366.1 2 261 260 756 757 758 760 762 646 663 667 736 738 737 739 799 787 782 781 780 779 778 777 776 693 Ephrin type-A receptor 2

Ligand: ZZL

Total number of chains: 7
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 4 57.1% 2WTVA
DFGin ABAminus 1 14.3% 2WTWA
DFGin None 1 14.3% 5IA1A
None None 1 14.3% 2X81A
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
CAMK AURKA AURKA_HUMAN 2WTWA O14965 128 389 403.0 ZZL:1390 Type1 Inactive DFGin 5.029 15.53 ABAminus -106.44, -45.36 -104.13, 150.11 -135.47, 26.63 287.92, 83.14 -51.9, -25.54 out-out out 11.468 Saltbr-out 6.023 HRD-in -69.03, -60.65 76.28, -17.41 out-in-out SNCoio in-out ActLoopNT-in 2.867 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nnoo APE10-dihe-na 999.0, 10.4 APE9-dihe-na -133.69, -108.65 APE8-dihe-in -91.45, 126.3 APE8-rot-in 315.62 APE67-dihe-in -56.65, -42.97 -87.39, -8.96 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 10.643 APE9-dist-out 10.37 L215R,T217E,R220K None None XRAY 3.302 0.236 0.288 A 285 256 6 0 0 6 [[133, 383]] 1.0 2wtw Homo sapiens CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVA O14965 125 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.701 9.454 None -75.22, 156.08 -105.21, 156.98 57.55, 45.32 319.02, 110.91 -59.58, -21.68 out-out out 12.224 Saltbr-out 9.738 HRD-out 56.62, 39.51 -65.34, 136.35 out-out-out SNCooo out-out ActLoopNT-out 17.312 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iioo APE10-dihe-na -58.52, -47.8 APE9-dihe-na -54.18, -45.12 APE8-dihe-out -70.51, -43.3 APE8-rot-in 297.14 APE67-dihe-in -48.3, -25.92 -57.93, -45.43 APE12-dist-in 8.287 APE11-dist-in 12.32 APE10-dist-out 15.039 APE9-dist-out 12.589 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 A 285 265 0 0 0 0 [[133, 383]] 1.0 2wtv Homo sapiens CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVB O14965 126 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.619 9.422 None -74.68, 158.58 -101.8, 146.26 63.97, 49.3 317.28, 114.07 -55.55, -26.4 out-out out 12.419 Saltbr-out 10.297 HRD-out -138.44, 123.91 -119.97, 134.75 out-out-out SNCooo out-out ActLoopNT-out 19.511 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na 85.02, 1.5 APE9-dihe-na 116.84, -135.44 APE8-dihe-in -82.25, 112.82 APE8-rot-in 306.92 APE67-dihe-in -64.29, -12.84 -49.83, -55.07 APE12-dist-out 14.754 APE11-dist-out 14.75 APE10-dist-out 12.235 APE9-dist-out 12.287 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 B 285 264 0 0 0 0 [[133, 383]] 1.0 2wtv Homo sapiens CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVC O14965 126 389 403.0 ZZL:1392 Type1 Inactive DFGinter 5.656 9.361 None -73.47, 155.34 -96.85, 146.28 67.08, 43.87 316.19, 116.1 -46.77, -31.93 out-out out 12.389 Saltbr-out 10.306 HRD-out -138.88, 125.11 -124.14, 137.81 out-out-out SNCooo out-out ActLoopNT-out 19.519 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oooo APE10-dihe-na 85.46, 1.21 APE9-dihe-na 119.13, -135.87 APE8-dihe-in -82.97, 108.09 APE8-rot-in 299.33 APE67-dihe-in -62.27, -12.5 -42.96, -58.15 APE12-dist-out 14.766 APE11-dist-out 14.728 APE10-dist-out 12.267 APE9-dist-out 12.403 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 C 285 264 0 0 0 0 [[133, 383]] 1.0 2wtv Homo sapiens CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2WTVD O14965 125 389 403.0 ZZL:1390 Type1 Inactive DFGinter 5.688 9.447 None -74.49, 159.41 -108.43, 161.13 55.07, 43.29 317.21, 115.65 -58.54, -27.22 out-out out 12.194 Saltbr-out 9.796 HRD-out 49.31, 42.91 -68.48, 131.43 out-out-out SNCooo out-out ActLoopNT-out 17.059 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iioo APE10-dihe-na -57.61, -41.18 APE9-dihe-na -56.01, -51.32 APE8-dihe-out -76.54, -36.16 APE8-rot-out 70.56 APE67-dihe-in -47.19, -33.07 -56.26, -46.95 APE12-dist-in 8.314 APE11-dist-in 12.48 APE10-dist-out 15.096 APE9-dist-out 12.493 L215R,T217E,R220K TPO287,TPO288 TPO287,TPO288,CME290 XRAY 2.4 0.167 0.211 D 285 265 0 0 0 0 [[133, 383]] 1.0 2wtv Homo sapiens CAMK_AURKA_HUMAN CAMK 2.7e-81 278.6 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
CAMK AURKA AURKA_HUMAN 2X81A O14965 127 388 403.0 ZZL:1389 Type1 Inactive None 999.0 999.0 None -101.61, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 999.0, 999.0 out-none out 11.657 Saltbr-none 999.0 HRD-in -75.09, -52.06 78.45, -27.83 none-none-out SNCnno none-out ActLoopNT-none 999.0 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -158.98 APE8-dihe-in -83.83, 140.8 APE8-rot-out 188.92 APE67-dihe-in -38.04, -33.42 -91.87, -17.9 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 11.297 None None None XRAY 2.91 0.247 0.303 A 272 242 20 0 0 17 [[133, 383]] 1.0 2x81 Homo sapiens CAMK_AURKA_HUMAN CAMK 6.4e-80 274.1 1 256 256 273 274 275 277 279 162 181 185 253 255 254 256 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
TYR EPHA2 EPHA2_HUMAN 5IA1A P29317 605 888 976.0 ZZL:1001 Type1 Inactive DFGin 5.104 13.44 None -130.45, -159.4 76.21, -65.85 93.22, -3.68 287.63, 98.57 73.71, -159.39 in-in in 8.825 Saltbr-in 3.231 HRD-in -77.12, -51.78 78.89, -19.53 in-none-none SNCinn none-none ActLoopNT-none 999.0 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 94.06 APE8-dihe-in -70.6, 101.8 APE8-rot-na 29.53 APE67-dihe-in -68.76, -14.33 -55.26, -45.36 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 5.783 None None None XRAY 2.036 0.183 0.223 A 306 261 23 0 0 17 [[613, 873]] 1.0 5ia1 Homo sapiens TYR_EPHA2_HUMAN TYR 5.5e-108 366.1 2 261 260 756 757 758 760 762 646 663 667 736 738 737 739 799 787 782 781 780 779 778 777 776 693 Ephrin type-A receptor 2

Ligand: ZZL

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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