Ligand: A1EG1

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 3 100.0% 9KS5B
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
CAMK AURKA AURKA_HUMAN 9KS6A O14965 127 391 403.0 A1EG1:162 Type1 Inactive DFGinter 5.888 9.1061 None -147.81, 30.43 -100.08, -15.16 61.73, 18.3 290.83, 10.75 -77.9, 72.48 out-na out 12.4716 Saltbr-na 9.13 HRD-out -111.85, 134.04 -63.11, -66.03 na-none-none SNCann none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 127.23 APE8-rot-in 299.78 APE67-dihe-in -48.85, -29.53 -94.69, -1.61 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None A1EG1162 XRAY 2.75 0.232 0.267 A 265.0 251.0 14 26 12 14 [[133, 383]] 1.0 9ks6 CAMK_AURKA_HUMAN CAMK 2.5e-78 268.8 1.0 256.0 256.0 273 274 275 277 279 162 181 185 253 255 254 256.0 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
TYR ABL1 ABL1_HUMAN 9KS5A P00519 233 500 1130.0 A1EG1:271 Type1.5_Front Inactive DFGinter 8.7305 5.5961 None -72.67, 142.35 -137.94, 44.53 -78.62, -20.52 286.29, 105.37 -105.91, 20.09 in-na in 9.0052 Saltbr-na 6.5449 HRD-in -99.23, -52.74 79.62, -6.89 na-out-in SNCaoi out-in ActLoopNT-out 5.8077 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -110.95, 133.03 APE9-dihe-in -106.8, 158.22 APE8-dihe-in -76.47, 95.45 APE8-rot-na 26.95 APE67-dihe-in -74.68, -6.25 -55.43, -44.13 APE12-dist-na 19.8189 APE11-dist-na 15.2479 APE10-dist-na 18.1002 APE9-dist-in 7.5449 None PTR393 A1EG1271,PTR393 XRAY 2.2 0.172 0.212 A 272.0 267.0 1 29 29 0 [[242, 495]] 1.0 9ks5 TYR_ABL1_HUMAN TYR 1.6e-98 335.1 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1
TYR ABL1 ABL1_HUMAN 9KS5B P00519 233 500 1130.0 A1EG1:271 Type1.5_Front Inactive DFGinter 8.9707 5.8466 None -69.26, 149.18 -127.32, 25.05 -69.17, -24.35 300.43, 107.89 -96.85, 31.16 in-na in 8.9604 Saltbr-na 6.2903 HRD-out -120.48, 122.49 -83.95, -2.51 na-out-in SNCaoi out-in ActLoopNT-out 5.4644 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -105.41, 141.36 APE9-dihe-in -120.7, 148.99 APE8-dihe-in -66.45, 102.07 APE8-rot-na 24.98 APE67-dihe-in -72.47, -9.8 -51.6, -47.65 APE12-dist-na 18.4239 APE11-dist-na 14.0576 APE10-dist-na 17.2646 APE9-dist-in 6.8918 None PTR393 A1EG1271,PTR393 XRAY 2.2 0.172 0.212 B 272.0 268.0 0 29 29 0 [[242, 495]] 1.0 9ks5 TYR_ABL1_HUMAN TYR 1.6e-98 335.1 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1

Ligand: A1EG1

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 3 100.0% 9KS5B
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
CAMK AURKA AURKA_HUMAN 9KS6A O14965 127 391 403.0 A1EG1:162 Type1 Inactive DFGinter 5.888 9.1061 None -147.81, 30.43 -100.08, -15.16 61.73, 18.3 290.83, 10.75 -77.9, 72.48 out-na out 12.4716 Saltbr-na 9.13 HRD-out -111.85, 134.04 -63.11, -66.03 na-none-none SNCann none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanii APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 127.23 APE8-rot-in 299.78 APE67-dihe-in -48.85, -29.53 -94.69, -1.61 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None A1EG1162 XRAY 2.75 0.232 0.267 A 265.0 251.0 14 26 12 14 [[133, 383]] 1.0 9ks6 Homo sapiens CAMK_AURKA_HUMAN CAMK 2.5e-78 268.8 1.0 256.0 256.0 273 274 275 277 279 162 181 185 253 255 254 256.0 311 299 294 293 292 291 290 289 288 211 Aurora kinase A
TYR ABL1 ABL1_HUMAN 9KS5A P00519 233 500 1130.0 A1EG1:271 Type1.5_Front Inactive DFGinter 8.7305 5.5961 None -72.67, 142.35 -137.94, 44.53 -78.62, -20.52 286.29, 105.37 -105.91, 20.09 in-na in 9.0052 Saltbr-na 6.5449 HRD-in -99.23, -52.74 79.62, -6.89 na-out-in SNCaoi out-in ActLoopNT-out 5.8077 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -110.95, 133.03 APE9-dihe-in -106.8, 158.22 APE8-dihe-in -76.47, 95.45 APE8-rot-na 26.95 APE67-dihe-in -74.68, -6.25 -55.43, -44.13 APE12-dist-na 19.8189 APE11-dist-na 15.2479 APE10-dist-na 18.1002 APE9-dist-in 7.5449 None PTR393 A1EG1271,PTR393 XRAY 2.2 0.172 0.212 A 272.0 267.0 1 29 29 0 [[242, 495]] 1.0 9ks5 Homo sapiens TYR_ABL1_HUMAN TYR 1.6e-98 335.1 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1
TYR ABL1 ABL1_HUMAN 9KS5B P00519 233 500 1130.0 A1EG1:271 Type1.5_Front Inactive DFGinter 8.9707 5.8466 None -69.26, 149.18 -127.32, 25.05 -69.17, -24.35 300.43, 107.89 -96.85, 31.16 in-na in 8.9604 Saltbr-na 6.2903 HRD-out -120.48, 122.49 -83.95, -2.51 na-out-in SNCaoi out-in ActLoopNT-out 5.4644 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -105.41, 141.36 APE9-dihe-in -120.7, 148.99 APE8-dihe-in -66.45, 102.07 APE8-rot-na 24.98 APE67-dihe-in -72.47, -9.8 -51.6, -47.65 APE12-dist-na 18.4239 APE11-dist-na 14.0576 APE10-dist-na 17.2646 APE9-dist-in 6.8918 None PTR393 A1EG1271,PTR393 XRAY 2.2 0.172 0.212 B 272.0 268.0 0 29 29 0 [[242, 495]] 1.0 9ks5 Homo sapiens TYR_ABL1_HUMAN TYR 1.6e-98 335.1 1.0 260.0 260.0 380 381 382 384 386 271 286 290 360 362 361 363.0 421 409 404 403 402 401 400 399 398 316 Tyrosine-protein kinase ABL1

Ligand: A1EG1

Total number of chains: 0
Active chains: 0
Total number of genes: 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
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