Ligand: AD6

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 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

Ligand: AD6

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 2VGPB
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 AURKBA AUKBA_XENLA 2VGPA Q6DE08 88 356 361.0 AD6:1357 Type1 Inactive DFGin 5.4486 15.8909 ABAminus -98.3, -33.69 -126.95, 134.94 -124.01, 35.67 285.65, 84.26 -61.41, -32.04 out-out out 10.7624 Saltbr-out 5.9522 HRD-in -76.86, -54.63 73.7, 5.15 out-in-in SNCoii in-in ActLoopNT-in 2.9704 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.89, 166.18 APE9-dihe-na 114.03, -139.03 APE8-dihe-in -137.76, 134.4 APE8-rot-in 302.62 APE67-dihe-in -68.68, -14.97 -37.15, -59.6 APE12-dist-in 8.2802 APE11-dist-in 10.9559 APE10-dist-in 5.3555 APE9-dist-in 3.5144 None TPO248 TPO248 XRAY 1.7 0.208 0.243 A 284.0 266.0 3 26 26 0 [[93, 343]] 1.0 2vgp Xenopus laevis CAMK_AURKBA_XENLA CAMK 2.5e-77 265.6 1.0 256.0 256.0 233 234 235 237 239 122 141 145 213 215 214 216.0 271 259 254 253 252 251 250 249 248 171 Aurora kinase B-A
CAMK AURKBA AUKBA_XENLA 2VGPB Q6DE08 78 355 361.0 AD6:1356 Type1 Inactive DFGin 5.8585 15.9866 ABAminus -105.69, -38.32 -114.16, 121.11 -114.2, 30.35 282.27, 78.52 -64.28, -21.51 out-out out 10.9977 Saltbr-out 5.8079 HRD-in -76.18, -52.02 74.91, -0.98 out-in-in SNCoii in-in ActLoopNT-in 2.9628 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -156.19, 163.44 APE9-dihe-na 125.86, -148.39 APE8-dihe-in -139.78, 135.67 APE8-rot-in 306.38 APE67-dihe-in -62.24, -22.22 -42.75, -57.14 APE12-dist-in 7.9432 APE11-dist-in 10.793 APE10-dist-in 5.2692 APE9-dist-in 3.5822 None TPO248 TPO248 XRAY 1.7 0.208 0.243 B 284.0 278.0 0 26 26 0 [[93, 343]] 1.0 2vgp Xenopus laevis CAMK_AURKBA_XENLA CAMK 2.5e-77 265.6 1.0 256.0 256.0 233 234 235 237 239 122 141 145 213 215 214 216.0 271 259 254 253 252 251 250 249 248 171 Aurora kinase B-A

Ligand: AD6

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 2VGPB
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 AURKBA AUKBA_XENLA 2VGPA Q6DE08 88 356 361.0 AD6:1357 Type1 Inactive DFGin 5.4486 15.8909 ABAminus -98.3, -33.69 -126.95, 134.94 -124.01, 35.67 285.65, 84.26 -61.41, -32.04 out-out out 10.7624 Saltbr-out 5.9522 HRD-in -76.86, -54.63 73.7, 5.15 out-in-in SNCoii in-in ActLoopNT-in 2.9704 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -153.89, 166.18 APE9-dihe-na 114.03, -139.03 APE8-dihe-in -137.76, 134.4 APE8-rot-in 302.62 APE67-dihe-in -68.68, -14.97 -37.15, -59.6 APE12-dist-in 8.2802 APE11-dist-in 10.9559 APE10-dist-in 5.3555 APE9-dist-in 3.5144 None TPO248 TPO248 XRAY 1.7 0.208 0.243 A 284.0 266.0 3 26 26 0 [[93, 343]] 1.0 2vgp Xenopus laevis CAMK_AURKBA_XENLA CAMK 2.5e-77 265.6 1.0 256.0 256.0 233 234 235 237 239 122 141 145 213 215 214 216.0 271 259 254 253 252 251 250 249 248 171 Aurora kinase B-A
CAMK AURKBA AUKBA_XENLA 2VGPB Q6DE08 78 355 361.0 AD6:1356 Type1 Inactive DFGin 5.8585 15.9866 ABAminus -105.69, -38.32 -114.16, 121.11 -114.2, 30.35 282.27, 78.52 -64.28, -21.51 out-out out 10.9977 Saltbr-out 5.8079 HRD-in -76.18, -52.02 74.91, -0.98 out-in-in SNCoii in-in ActLoopNT-in 2.9628 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -156.19, 163.44 APE9-dihe-na 125.86, -148.39 APE8-dihe-in -139.78, 135.67 APE8-rot-in 306.38 APE67-dihe-in -62.24, -22.22 -42.75, -57.14 APE12-dist-in 7.9432 APE11-dist-in 10.793 APE10-dist-in 5.2692 APE9-dist-in 3.5822 None TPO248 TPO248 XRAY 1.7 0.208 0.243 B 284.0 278.0 0 26 26 0 [[93, 343]] 1.0 2vgp Xenopus laevis CAMK_AURKBA_XENLA CAMK 2.5e-77 265.6 1.0 256.0 256.0 233 234 235 237 239 122 141 145 213 215 214 216.0 271 259 254 253 252 251 250 249 248 171 Aurora kinase B-A