Ligand: T28

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 1 50.0% 4IDTA
DFGin BLAminus 1 50.0% 4IDTB
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
STE MAP3K14 M3K14_HUMAN 4IDTA Q99558 333 675 947.0 T28:701 Type1 Inactive DFGin 4.8758 13.8166 ABAminus -117.12, -43.35 -121.41, 109.43 -99.77, 25.52 290.46, 73.92 -61.38, -16.41 in-in in 8.4798 Saltbr-in 2.3797 HRD-in -72.78, -55.15 91.97, -2.23 in-in-out SNCiio in-out ActLoopNT-in 3.0247 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -68.28, 142.29 APE9-dihe-na -90.08, -132.43 APE8-dihe-in -78.86, 127.33 APE8-rot-in 308.12 APE67-dihe-in -68.25, -18.35 -55.63, -34.44 APE12-dist-in 7.7836 APE11-dist-out 5.3341 APE10-dist-out 8.7145 APE9-dist-in 4.2553 None None None XRAY 2.4 0.193 0.228 A 356.0 334.0 9 33 24 9 [[399, 652]] 1.0 4idt STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 4IDTB Q99558 334 677 947.0 T28:701 Type1 Inactive DFGin 4.8332 14.0244 BLAminus -130.33, -176.63 40.62, 101.96 -102.91, 26.72 284.53, 73.19 -60.62, -17.23 in-in in 8.4331 Saltbr-in 2.3709 HRD-in -69.31, -53.69 93.06, -2.54 in-in-out SNCiio in-out ActLoopNT-in 3.1012 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -68.62, 143.95 APE9-dihe-na -89.97, -131.32 APE8-dihe-in -78.44, 127.75 APE8-rot-in 306.61 APE67-dihe-in -67.78, -16.44 -55.0, -35.16 APE12-dist-in 7.8153 APE11-dist-out 5.2852 APE10-dist-out 8.6647 APE9-dist-in 4.3785 None None None XRAY 2.4 0.193 0.228 B 356.0 335.0 9 33 24 9 [[399, 652]] 1.0 4idt STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14

Ligand: T28

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 1 50.0% 4IDTA
DFGin BLAminus 1 50.0% 4IDTB
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
STE MAP3K14 M3K14_HUMAN 4IDTA Q99558 333 675 947.0 T28:701 Type1 Inactive DFGin 4.8758 13.8166 ABAminus -117.12, -43.35 -121.41, 109.43 -99.77, 25.52 290.46, 73.92 -61.38, -16.41 in-in in 8.4798 Saltbr-in 2.3797 HRD-in -72.78, -55.15 91.97, -2.23 in-in-out SNCiio in-out ActLoopNT-in 3.0247 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -68.28, 142.29 APE9-dihe-na -90.08, -132.43 APE8-dihe-in -78.86, 127.33 APE8-rot-in 308.12 APE67-dihe-in -68.25, -18.35 -55.63, -34.44 APE12-dist-in 7.7836 APE11-dist-out 5.3341 APE10-dist-out 8.7145 APE9-dist-in 4.2553 None None None XRAY 2.4 0.193 0.228 A 356.0 334.0 9 33 24 9 [[399, 652]] 1.0 4idt Homo sapiens STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14
STE MAP3K14 M3K14_HUMAN 4IDTB Q99558 334 677 947.0 T28:701 Type1 Inactive DFGin 4.8332 14.0244 BLAminus -130.33, -176.63 40.62, 101.96 -102.91, 26.72 284.53, 73.19 -60.62, -17.23 in-in in 8.4331 Saltbr-in 2.3709 HRD-in -69.31, -53.69 93.06, -2.54 in-in-out SNCiio in-out ActLoopNT-in 3.1012 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -68.62, 143.95 APE9-dihe-na -89.97, -131.32 APE8-dihe-in -78.44, 127.75 APE8-rot-in 306.61 APE67-dihe-in -67.78, -16.44 -55.0, -35.16 APE12-dist-in 7.8153 APE11-dist-out 5.2852 APE10-dist-out 8.6647 APE9-dist-in 4.3785 None None None XRAY 2.4 0.193 0.228 B 356.0 335.0 9 33 24 9 [[399, 652]] 1.0 4idt Homo sapiens STE_MAP3K14_HUMAN STE 1.2e-62 217.7 4.0 252.0 249.0 533 534 535 537 539 429 440 444 512 514 513 515.0 578 566 561 560 559 558 557 556 555 470 Mitogen-activated protein kinase kinase kinase 14

Ligand: T28

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