Ligand: 8GY

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% 5UOXA
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 5UOXA Q99683 670 940 1374.0 8GY:1000 Type1 Inactive DFGin 6.7984 13.9876 BLAminus -128.31, 175.13 55.09, 92.72 -100.89, 23.01 297.63, 88.22 -70.07, -26.13 in-in in 8.5011 Saltbr-in 2.7564 HRD-in -71.84, -50.9 74.59, 7.46 in-in-out SNCiio in-out ActLoopNT-in 3.2138 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -131.88, 138.86 APE9-dihe-na -76.06, -175.52 APE8-dihe-in -63.3, 129.59 APE8-rot-in 321.22 APE67-dihe-in -67.41, -0.83 -64.06, -49.27 APE12-dist-in 10.7957 APE11-dist-out 5.5155 APE10-dist-out 10.05 APE9-dist-in 3.9524 None None None XRAY 2.5 0.229 0.253 A 271.0 263.0 8 28 20 8 [[678, 938]] 1.0 5uox 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 5UOXB Q99683 670 939 1374.0 8GY:1000 Type1 Inactive DFGin 6.5237 13.8162 BLAminus -134.06, 158.99 57.73, 94.5 -98.62, 19.22 300.63, 97.73 -64.04, -32.22 in-in in 8.5723 Saltbr-in 2.6608 HRD-in -75.21, -51.08 80.04, -0.5 in-in-out SNCiio in-out ActLoopNT-in 3.0193 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -128.94, 128.06 APE9-dihe-na -81.2, -167.19 APE8-dihe-in -52.73, 117.36 APE8-rot-in 317.57 APE67-dihe-in -83.41, -9.75 -51.91, -36.4 APE12-dist-in 11.747 APE11-dist-out 7.2975 APE10-dist-out 10.8804 APE9-dist-in 4.4863 None None None XRAY 2.5 0.229 0.253 B 271.0 252.0 18 28 20 8 [[678, 938]] 1.0 5uox 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: 8GY

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% 5UOXA
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 5UOXA Q99683 670 940 1374.0 8GY:1000 Type1 Inactive DFGin 6.7984 13.9876 BLAminus -128.31, 175.13 55.09, 92.72 -100.89, 23.01 297.63, 88.22 -70.07, -26.13 in-in in 8.5011 Saltbr-in 2.7564 HRD-in -71.84, -50.9 74.59, 7.46 in-in-out SNCiio in-out ActLoopNT-in 3.2138 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -131.88, 138.86 APE9-dihe-na -76.06, -175.52 APE8-dihe-in -63.3, 129.59 APE8-rot-in 321.22 APE67-dihe-in -67.41, -0.83 -64.06, -49.27 APE12-dist-in 10.7957 APE11-dist-out 5.5155 APE10-dist-out 10.05 APE9-dist-in 3.9524 None None None XRAY 2.5 0.229 0.253 A 271.0 263.0 8 28 20 8 [[678, 938]] 1.0 5uox 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 5UOXB Q99683 670 939 1374.0 8GY:1000 Type1 Inactive DFGin 6.5237 13.8162 BLAminus -134.06, 158.99 57.73, 94.5 -98.62, 19.22 300.63, 97.73 -64.04, -32.22 in-in in 8.5723 Saltbr-in 2.6608 HRD-in -75.21, -51.08 80.04, -0.5 in-in-out SNCiio in-out ActLoopNT-in 3.0193 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -128.94, 128.06 APE9-dihe-na -81.2, -167.19 APE8-dihe-in -52.73, 117.36 APE8-rot-in 317.57 APE67-dihe-in -83.41, -9.75 -51.91, -36.4 APE12-dist-in 11.747 APE11-dist-out 7.2975 APE10-dist-out 10.8804 APE9-dist-in 4.4863 None None None XRAY 2.5 0.229 0.253 B 271.0 252.0 18 28 20 8 [[678, 938]] 1.0 5uox 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: 8GY

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