Ligand: 0C5

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 2 100.0% 3UOJA
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 3UOJA O14965 127 389 403.0 0C5:1 Type1 Inactive DFGinter 6.2496 8.6517 None -89.03, -64.22 49.6, -140.48 55.65, -113.8 181.43, 6.66 -48.52, 138.84 out-out out 12.9006 Saltbr-out 10.1671 HRD-out 77.34, -11.89 -40.57, 125.77 out-out-out SNCooo out-out ActLoopNT-out 16.7655 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oioo APE10-dihe-na 98.97, 1.26 APE9-dihe-na -102.25, -2.44 APE8-dihe-out -61.85, -58.87 APE8-rot-out 33.31 APE67-dihe-in -56.59, -30.78 -67.25, -33.49 APE12-dist-out 15.3881 APE11-dist-in 12.5887 APE10-dist-out 17.4172 APE9-dist-out 14.292 T287D None None XRAY 2.9 0.227 0.274 A 279.0 263.0 0 26 26 0 [[133, 383]] 1.0 3uoj CAMK_AURKA_HUMAN CAMK 8.7e-80 273.7 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
CAMK AURKA AURKA_HUMAN 3UOJB O14965 127 389 403.0 0C5:2 Type1 Inactive DFGinter 6.2636 8.6447 None -88.87, -64.57 49.7, -140.5 55.59, -113.73 181.06, 6.55 -48.5, 138.54 out-out out 12.9094 Saltbr-out 10.1475 HRD-out 77.24, -11.84 -40.35, 125.95 out-out-out SNCooo out-out ActLoopNT-out 16.7603 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oioo APE10-dihe-na 98.86, 1.29 APE9-dihe-na -101.95, -2.75 APE8-dihe-out -62.17, -58.93 APE8-rot-out 33.01 APE67-dihe-in -57.8, -30.14 -66.39, -33.04 APE12-dist-out 15.3867 APE11-dist-in 12.5858 APE10-dist-out 17.4158 APE9-dist-out 14.2887 T287D None None XRAY 2.9 0.227 0.274 B 279.0 263.0 0 26 26 0 [[133, 383]] 1.0 3uoj CAMK_AURKA_HUMAN CAMK 8.7e-80 273.7 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

Ligand: 0C5

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGinter None 2 100.0% 3UOJA
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 3UOJA O14965 127 389 403.0 0C5:1 Type1 Inactive DFGinter 6.2496 8.6517 None -89.03, -64.22 49.6, -140.48 55.65, -113.8 181.43, 6.66 -48.52, 138.84 out-out out 12.9006 Saltbr-out 10.1671 HRD-out 77.34, -11.89 -40.57, 125.77 out-out-out SNCooo out-out ActLoopNT-out 16.7655 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oioo APE10-dihe-na 98.97, 1.26 APE9-dihe-na -102.25, -2.44 APE8-dihe-out -61.85, -58.87 APE8-rot-out 33.31 APE67-dihe-in -56.59, -30.78 -67.25, -33.49 APE12-dist-out 15.3881 APE11-dist-in 12.5887 APE10-dist-out 17.4172 APE9-dist-out 14.292 T287D None None XRAY 2.9 0.227 0.274 A 279.0 263.0 0 26 26 0 [[133, 383]] 1.0 3uoj Homo sapiens CAMK_AURKA_HUMAN CAMK 8.7e-80 273.7 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
CAMK AURKA AURKA_HUMAN 3UOJB O14965 127 389 403.0 0C5:2 Type1 Inactive DFGinter 6.2636 8.6447 None -88.87, -64.57 49.7, -140.5 55.59, -113.73 181.06, 6.55 -48.5, 138.54 out-out out 12.9094 Saltbr-out 10.1475 HRD-out 77.24, -11.84 -40.35, 125.95 out-out-out SNCooo out-out ActLoopNT-out 16.7603 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oioo APE10-dihe-na 98.86, 1.29 APE9-dihe-na -101.95, -2.75 APE8-dihe-out -62.17, -58.93 APE8-rot-out 33.01 APE67-dihe-in -57.8, -30.14 -66.39, -33.04 APE12-dist-out 15.3867 APE11-dist-in 12.5858 APE10-dist-out 17.4158 APE9-dist-out 14.2887 T287D None None XRAY 2.9 0.227 0.274 B 279.0 263.0 0 26 26 0 [[133, 383]] 1.0 3uoj Homo sapiens CAMK_AURKA_HUMAN CAMK 8.7e-80 273.7 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

Ligand: 0C5

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