Ligand: ZRR

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8GMDA
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
OTHER AAK1 AAK1_HUMAN 8GMDA Q2M2I8 34 329 961.0 ZRR:401 Type1 Active DFGin 6.1668 13.3321 BLAminus -127.52, 174.84 65.86, 97.82 -104.03, 21.57 300.09, 93.49 -64.42, -30.01 in-in in 8.5756 Saltbr-in 2.7839 HRD-in -64.68, -46.09 71.69, -3.04 in-in-in SNCiii in-in ActLoopNT-in 2.9742 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -108.71, -15.11 APE9-dihe-na -111.33, 160.49 APE8-dihe-in -104.37, 121.78 APE8-rot-in 304.75 APE67-dihe-in -58.75, -28.21 -47.17, -46.33 APE12-dist-in 12.1626 APE11-dist-in 8.4335 APE10-dist-in 4.1468 APE9-dist-in 3.5664 None None None XRAY 2.2 0.233 0.25 A 318.0 294.0 2 36 36 0 [[46, 313]] 1.0 8gmd OTHER_AAK1_HUMAN OTHER 3.6e-41 147.6 3.0 254.0 252.0 193 194 195 197 199 74 90 94 173 175 174 176.0 244 229 224 223 222 221 220 219 218 127 AP2-associated protein kinase 1
OTHER AAK1 AAK1_HUMAN 8GMDB Q2M2I8 29 330 961.0 ZRR:401 Type1 Active DFGin 6.3724 13.4776 BLAminus -123.19, 179.01 67.0, 97.52 -104.44, 17.42 296.06, 83.59 -61.74, -25.96 in-in in 8.4316 Saltbr-in 2.7776 HRD-in -64.58, -45.6 71.56, -2.33 in-in-in SNCiii in-in ActLoopNT-in 2.9573 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -115.95, -11.7 APE9-dihe-na -117.06, 155.74 APE8-dihe-in -98.45, 121.78 APE8-rot-in 305.28 APE67-dihe-in -59.45, -28.48 -46.11, -46.72 APE12-dist-in 12.1776 APE11-dist-in 8.3744 APE10-dist-in 4.1429 APE9-dist-in 3.5971 None None None XRAY 2.2 0.233 0.25 B 318.0 299.0 3 36 36 0 [[46, 313]] 1.0 8gmd OTHER_AAK1_HUMAN OTHER 3.6e-41 147.6 3.0 254.0 252.0 193 194 195 197 199 74 90 94 173 175 174 176.0 244 229 224 223 222 221 220 219 218 127 AP2-associated protein kinase 1

Ligand: ZRR

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 8GMDA
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
OTHER AAK1 AAK1_HUMAN 8GMDA Q2M2I8 34 329 961.0 ZRR:401 Type1 Active DFGin 6.1668 13.3321 BLAminus -127.52, 174.84 65.86, 97.82 -104.03, 21.57 300.09, 93.49 -64.42, -30.01 in-in in 8.5756 Saltbr-in 2.7839 HRD-in -64.68, -46.09 71.69, -3.04 in-in-in SNCiii in-in ActLoopNT-in 2.9742 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -108.71, -15.11 APE9-dihe-na -111.33, 160.49 APE8-dihe-in -104.37, 121.78 APE8-rot-in 304.75 APE67-dihe-in -58.75, -28.21 -47.17, -46.33 APE12-dist-in 12.1626 APE11-dist-in 8.4335 APE10-dist-in 4.1468 APE9-dist-in 3.5664 None None None XRAY 2.2 0.233 0.25 A 318.0 294.0 2 36 36 0 [[46, 313]] 1.0 8gmd Homo sapiens OTHER_AAK1_HUMAN OTHER 3.6e-41 147.6 3.0 254.0 252.0 193 194 195 197 199 74 90 94 173 175 174 176.0 244 229 224 223 222 221 220 219 218 127 AP2-associated protein kinase 1
OTHER AAK1 AAK1_HUMAN 8GMDB Q2M2I8 29 330 961.0 ZRR:401 Type1 Active DFGin 6.3724 13.4776 BLAminus -123.19, 179.01 67.0, 97.52 -104.44, 17.42 296.06, 83.59 -61.74, -25.96 in-in in 8.4316 Saltbr-in 2.7776 HRD-in -64.58, -45.6 71.56, -2.33 in-in-in SNCiii in-in ActLoopNT-in 2.9573 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -115.95, -11.7 APE9-dihe-na -117.06, 155.74 APE8-dihe-in -98.45, 121.78 APE8-rot-in 305.28 APE67-dihe-in -59.45, -28.48 -46.11, -46.72 APE12-dist-in 12.1776 APE11-dist-in 8.3744 APE10-dist-in 4.1429 APE9-dist-in 3.5971 None None None XRAY 2.2 0.233 0.25 B 318.0 299.0 3 36 36 0 [[46, 313]] 1.0 8gmd Homo sapiens OTHER_AAK1_HUMAN OTHER 3.6e-41 147.6 3.0 254.0 252.0 193 194 195 197 199 74 90 94 173 175 174 176.0 244 229 224 223 222 221 220 219 218 127 AP2-associated protein kinase 1

Ligand: ZRR

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