Ligand: 8V7

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 5V24B
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 MAP3K5 M3K5_HUMAN 5V24A Q99683 671 939 1374.0 8V7:1000 Type1 Inactive DFGin 6.4441 13.8223 BLAminus -138.79, 167.29 63.07, 92.92 -98.6, 22.14 301.17, 102.16 -63.35, -34.76 in-in in 8.5518 Saltbr-in 2.6535 HRD-in -79.39, -51.03 79.68, 9.93 in-in-out SNCiio in-out ActLoopNT-in 2.9005 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooi APE10-dihe-na -142.07, 141.87 APE9-dihe-na -76.32, -161.06 APE8-dihe-in -57.75, 128.66 APE8-rot-in 314.65 APE67-dihe-in -85.33, 2.43 -49.1, -51.24 APE12-dist-none 999.0 APE11-dist-out 7.3594 APE10-dist-out 10.5729 APE9-dist-in 4.0312 None None None XRAY 2.5 0.236 0.266 A 271.0 249.0 20 28 19 9 [[678, 938]] 1.0 5v24 STE_MAP3K5_HUMAN STE 4.4e-81 278.0 5.0 257.0 253.0 821 822 823 825 827 709 725 729 800 802 801 803.0 863 849 844 843 842 841 840 839 838 755 Mitogen-activated protein kinase kinase kinase 5
STE MAP3K5 M3K5_HUMAN 5V24B Q99683 670 940 1374.0 8V7:1000 Type1 Inactive DFGin 6.686 13.9471 BLAminus -131.97, 172.62 55.9, 93.07 -102.8, 24.69 298.12, 84.91 -61.85, -39.9 in-in in 8.4822 Saltbr-in 2.6787 HRD-in -70.58, -49.83 74.61, 10.19 in-in-out SNCiio in-out ActLoopNT-in 3.1261 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -138.19, 141.87 APE9-dihe-na -76.77, -161.96 APE8-dihe-in -77.94, 133.6 APE8-rot-in 312.69 APE67-dihe-in -60.64, -16.25 -59.43, -53.7 APE12-dist-in 10.4069 APE11-dist-out 5.9236 APE10-dist-out 9.9336 APE9-dist-in 3.9222 None None None XRAY 2.5 0.236 0.266 B 271.0 263.0 8 28 20 8 [[678, 938]] 1.0 5v24 STE_MAP3K5_HUMAN STE 4.4e-81 278.0 5.0 257.0 253.0 821 822 823 825 827 709 725 729 800 802 801 803.0 863 849 844 843 842 841 840 839 838 755 Mitogen-activated protein kinase kinase kinase 5

Ligand: 8V7

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 5V24B
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 MAP3K5 M3K5_HUMAN 5V24A Q99683 671 939 1374.0 8V7:1000 Type1 Inactive DFGin 6.4441 13.8223 BLAminus -138.79, 167.29 63.07, 92.92 -98.6, 22.14 301.17, 102.16 -63.35, -34.76 in-in in 8.5518 Saltbr-in 2.6535 HRD-in -79.39, -51.03 79.68, 9.93 in-in-out SNCiio in-out ActLoopNT-in 2.9005 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooi APE10-dihe-na -142.07, 141.87 APE9-dihe-na -76.32, -161.06 APE8-dihe-in -57.75, 128.66 APE8-rot-in 314.65 APE67-dihe-in -85.33, 2.43 -49.1, -51.24 APE12-dist-none 999.0 APE11-dist-out 7.3594 APE10-dist-out 10.5729 APE9-dist-in 4.0312 None None None XRAY 2.5 0.236 0.266 A 271.0 249.0 20 28 19 9 [[678, 938]] 1.0 5v24 Homo sapiens STE_MAP3K5_HUMAN STE 4.4e-81 278.0 5.0 257.0 253.0 821 822 823 825 827 709 725 729 800 802 801 803.0 863 849 844 843 842 841 840 839 838 755 Mitogen-activated protein kinase kinase kinase 5
STE MAP3K5 M3K5_HUMAN 5V24B Q99683 670 940 1374.0 8V7:1000 Type1 Inactive DFGin 6.686 13.9471 BLAminus -131.97, 172.62 55.9, 93.07 -102.8, 24.69 298.12, 84.91 -61.85, -39.9 in-in in 8.4822 Saltbr-in 2.6787 HRD-in -70.58, -49.83 74.61, 10.19 in-in-out SNCiio in-out ActLoopNT-in 3.1261 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -138.19, 141.87 APE9-dihe-na -76.77, -161.96 APE8-dihe-in -77.94, 133.6 APE8-rot-in 312.69 APE67-dihe-in -60.64, -16.25 -59.43, -53.7 APE12-dist-in 10.4069 APE11-dist-out 5.9236 APE10-dist-out 9.9336 APE9-dist-in 3.9222 None None None XRAY 2.5 0.236 0.266 B 271.0 263.0 8 28 20 8 [[678, 938]] 1.0 5v24 Homo sapiens STE_MAP3K5_HUMAN STE 4.4e-81 278.0 5.0 257.0 253.0 821 822 823 825 827 709 725 729 800 802 801 803.0 863 849 844 843 842 841 840 839 838 755 Mitogen-activated protein kinase kinase kinase 5

Ligand: 8V7

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