Ligand: AQY

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 1 50.0% 9BP8A
DFGinter None 1 50.0% 5WJJA
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
CMGC MAPK14 MK14_HUMAN 5WJJA Q16539 5 352 360.0 AQY:501 Type1 Inactive DFGinter 10.159 9.062 None -113.52, 161.05 -110.02, 23.38 -151.72, 163.67 53.5, 90.99 -95.62, 149.45 in-in in 9.566 Saltbr-in 3.445 HRD-in -66.13, -48.01 74.38, -15.21 in-out-out SNCioo out-out ActLoopNT-out 22.96 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 151.37 APE8-dihe-out -54.87, -43.06 APE8-rot-in 316.01 APE67-dihe-in -61.84, -23.7 -56.22, -24.16 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 12.145 None None None XRAY 1.6 0.202 0.237 A 365 338 10 0 0 6 [[24, 308]] 1.0 5wjj CMGC_MAPK14_HUMAN CMGC 8.5e-85 290.6 1 301 301 167 168 169 171 173 53 71 75 147 149 148 150 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
TKL BRAF BRAF_HUMAN 9BP8A P15056 449 721 766.0 A1AQY:801 Type1 Inactive DFGin 5.22 13.557 BLAplus -129.41, -173.26 66.62, 35.11 -102.57, -8.15 57.04, 89.1 -72.95, 156.71 out-out out 13.126 Saltbr-out 11.44 HRD-in -67.37, -53.21 82.55, -13.02 out-out-out SNCooo out-out ActLoopNT-out 9.031 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -60.62, -35.92 APE9-dihe-na -79.61, -15.25 APE8-dihe-out -112.44, -12.93 APE8-rot-in 291.55 APE67-dihe-in -61.23, -28.38 -53.66, -40.13 APE12-dist-in 11.885 APE11-dist-out 16.59 APE10-dist-out 19.005 APE9-dist-out 10.527 F667A,R671A,Y673A None None XRAY 1.73 0.166 0.193 A 294 273 0 0 0 0 [[457, 716]] 1.0 9bp8 TKL_BRAF_HUMAN TKL 1e-81 280.4 4 266 263 593 594 595 597 599 483 501 505 573 575 574 576 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf

Ligand: AQY

Total number of chains: 2
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 1 50.0% 9BP8A
DFGinter None 1 50.0% 5WJJA
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
CMGC MAPK14 MK14_HUMAN 5WJJA Q16539 5 352 360.0 AQY:501 Type1 Inactive DFGinter 10.159 9.062 None -113.52, 161.05 -110.02, 23.38 -151.72, 163.67 53.5, 90.99 -95.62, 149.45 in-in in 9.566 Saltbr-in 3.445 HRD-in -66.13, -48.01 74.38, -15.21 in-out-out SNCioo out-out ActLoopNT-out 22.96 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nnno APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 151.37 APE8-dihe-out -54.87, -43.06 APE8-rot-in 316.01 APE67-dihe-in -61.84, -23.7 -56.22, -24.16 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-out 12.145 None None None XRAY 1.6 0.202 0.237 A 365 338 10 0 0 6 [[24, 308]] 1.0 5wjj Homo sapiens CMGC_MAPK14_HUMAN CMGC 8.5e-85 290.6 1 301 301 167 168 169 171 173 53 71 75 147 149 148 150 205 192 187 186 185 184 183 182 181 107 Mitogen-activated protein kinase 14
TKL BRAF BRAF_HUMAN 9BP8A P15056 449 721 766.0 A1AQY:801 Type1 Inactive DFGin 5.22 13.557 BLAplus -129.41, -173.26 66.62, 35.11 -102.57, -8.15 57.04, 89.1 -72.95, 156.71 out-out out 13.126 Saltbr-out 11.44 HRD-in -67.37, -53.21 82.55, -13.02 out-out-out SNCooo out-out ActLoopNT-out 9.031 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -60.62, -35.92 APE9-dihe-na -79.61, -15.25 APE8-dihe-out -112.44, -12.93 APE8-rot-in 291.55 APE67-dihe-in -61.23, -28.38 -53.66, -40.13 APE12-dist-in 11.885 APE11-dist-out 16.59 APE10-dist-out 19.005 APE9-dist-out 10.527 F667A,R671A,Y673A None None XRAY 1.73 0.166 0.193 A 294 273 0 0 0 0 [[457, 716]] 1.0 9bp8 Homo sapiens TKL_BRAF_HUMAN TKL 1e-81 280.4 4 266 263 593 594 595 597 599 483 501 505 573 575 574 576 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf

Ligand: AQY

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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