Ligand: F8Z

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 6GR8A
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 6GRAA O14965 126 389 403.0 F8Z:501 Type1.5_Front Inactive DFGin 5.0091 16.6676 ABAminus -83.94, -29.2 -118.43, -178.38 -109.45, -4.58 278.61, 93.03 97.03, -121.48 out-out out 11.0182 Saltbr-out 9.6394 HRD-in -78.52, -51.2 68.01, 5.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanni APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 67.95 APE8-rot-none 999.0 APE67-dihe-in -48.59, -35.52 -71.59, -26.29 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 2.6 0.213 0.269 A 285.0 250.0 14 26 12 14 [[133, 383]] 1.0 6gra CAMK_AURKA_HUMAN CAMK 7.7e-80 273.8 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
CAMK AURKC AURKC_HUMAN 6GR8A Q9UQB9 36 303 309.0 F8Z:60401 Type1.5_Front Inactive DFGin 6.3882 16.3688 ABAminus -86.33, -37.22 -148.5, 121.35 -101.84, 15.84 276.95, 115.08 -62.41, -31.31 out-out out 10.6586 Saltbr-out 7.7558 HRD-in -76.6, -55.3 75.61, 5.87 out-in-out SNCoio in-out ActLoopNT-in 3.0175 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -139.48, 154.35 APE9-dihe-na 86.68, -167.53 APE8-dihe-in -103.19, 151.93 APE8-rot-out 71.83 APE67-dihe-in -66.94, -16.94 -38.52, -57.04 APE12-dist-in 8.1613 APE11-dist-in 10.454 APE10-dist-in 5.3796 APE9-dist-in 3.7534 None TPO39,TPO198 TPO39,TPO198 XRAY 1.75 0.178 0.216 A 274.0 268.0 0 26 26 0 [[43, 293]] 1.0 6gr8 CAMK_AURKC_HUMAN CAMK 1e-80 276.7 1.0 256.0 256.0 183 184 185 187 189 72 91 95 163 165 164 166.0 221 209 204 203 202 201 200 199 198 121 Aurora kinase C

Ligand: F8Z

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 6GR8A
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 6GRAA O14965 126 389 403.0 F8Z:501 Type1.5_Front Inactive DFGin 5.0091 16.6676 ABAminus -83.94, -29.2 -118.43, -178.38 -109.45, -4.58 278.61, 93.03 97.03, -121.48 out-out out 11.0182 Saltbr-out 9.6394 HRD-in -78.52, -51.2 68.01, 5.59 out-none-none SNConn none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aanni APEdist_nnnn APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 999.0 APE8-dihe-none 999.0, 67.95 APE8-rot-none 999.0 APE67-dihe-in -48.59, -35.52 -71.59, -26.29 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-none 999.0 None None None XRAY 2.6 0.213 0.269 A 285.0 250.0 14 26 12 14 [[133, 383]] 1.0 6gra Homo sapiens CAMK_AURKA_HUMAN CAMK 7.7e-80 273.8 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
CAMK AURKC AURKC_HUMAN 6GR8A Q9UQB9 36 303 309.0 F8Z:60401 Type1.5_Front Inactive DFGin 6.3882 16.3688 ABAminus -86.33, -37.22 -148.5, 121.35 -101.84, 15.84 276.95, 115.08 -62.41, -31.31 out-out out 10.6586 Saltbr-out 7.7558 HRD-in -76.6, -55.3 75.61, 5.87 out-in-out SNCoio in-out ActLoopNT-in 3.0175 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -139.48, 154.35 APE9-dihe-na 86.68, -167.53 APE8-dihe-in -103.19, 151.93 APE8-rot-out 71.83 APE67-dihe-in -66.94, -16.94 -38.52, -57.04 APE12-dist-in 8.1613 APE11-dist-in 10.454 APE10-dist-in 5.3796 APE9-dist-in 3.7534 None TPO39,TPO198 TPO39,TPO198 XRAY 1.75 0.178 0.216 A 274.0 268.0 0 26 26 0 [[43, 293]] 1.0 6gr8 Homo sapiens CAMK_AURKC_HUMAN CAMK 1e-80 276.7 1.0 256.0 256.0 183 184 185 187 189 72 91 95 163 165 164 166.0 221 209 204 203 202 201 200 199 198 121 Aurora kinase C

Ligand: F8Z

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