Ligand: 95U

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 5Z1DA
DFGout None 1 50.0% 5Z1EA
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 MAP2K7 MP2K7_HUMAN 5Z1DA O14733 103 403 419.0 95U:60501 Type1 None DFGin 5.8572 14.5846 BLAminus -132.64, 165.55 65.51, 87.28 -111.34, 26.51 319.06, 84.39 -58.48, -30.36 in-na in 8.3569 Saltbr-na 4.0434 HRD-in -83.1, -42.1 68.08, 4.78 na-none-none SNCann none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiai APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 121.65 APE8-dihe-in -8.48, 107.0 APE8-rot-na 193.18 APE67-dihe-in -53.9, -37.87 -45.41, -42.12 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.9979 None None None XRAY 2.28 0.195 0.258 A 324.0 274.0 27 27 14 13 [[120, 380]] 1.0 5z1d STE_MAP2K7_HUMAN STE 9.7e-80 273.6 2.0 257.0 256.0 260 261 262 264 266 149 166 170 240 242 241 243.0 304 287 282 281 280 279 278 277 276 197 Dual specificity mitogen-activated protein kinase kinase 7
STE MAP2K7 MP2K7_HUMAN 5Z1EA O14733 103 419 419.0 95U:60501 Type1 Inactive DFGout 14.5039 12.6055 None -85.05, 151.13 -68.45, -19.93 -71.62, 116.06 181.31, 86.38 78.35, 8.74 in-na in 9.4863 Saltbr-na 6.0011 HRD-in -59.34, -43.5 68.0, 9.1 na-out-none SNCaon out-none ActLoopNT-out 4.5474 ActLoopCT-none nonTYR APEdihe_aaiai APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -160.98 APE8-dihe-in -89.81, 122.82 APE8-rot-na 181.7 APE67-dihe-in -53.89, -34.76 -49.14, -44.64 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.0891 None None None XRAY 2.3 0.199 0.283 A 324.0 295.0 21 27 15 12 [[120, 380]] 1.0 5z1e STE_MAP2K7_HUMAN STE 6.1e-81 277.5 2.0 257.0 256.0 260 261 262 264 266 149 166 170 240 242 241 243.0 304 287 282 281 280 279 278 277 276 197 Dual specificity mitogen-activated protein kinase kinase 7

Ligand: 95U

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 5Z1DA
DFGout None 1 50.0% 5Z1EA
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 MAP2K7 MP2K7_HUMAN 5Z1DA O14733 103 403 419.0 95U:60501 Type1 None DFGin 5.8572 14.5846 BLAminus -132.64, 165.55 65.51, 87.28 -111.34, 26.51 319.06, 84.39 -58.48, -30.36 in-na in 8.3569 Saltbr-na 4.0434 HRD-in -83.1, -42.1 68.08, 4.78 na-none-none SNCann none-none ActLoopNT-none 999.0 ActLoopCT-none nonTYR APEdihe_aaiai APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, 121.65 APE8-dihe-in -8.48, 107.0 APE8-rot-na 193.18 APE67-dihe-in -53.9, -37.87 -45.41, -42.12 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 3.9979 None None None XRAY 2.28 0.195 0.258 A 324.0 274.0 27 27 14 13 [[120, 380]] 1.0 5z1d Homo sapiens STE_MAP2K7_HUMAN STE 9.7e-80 273.6 2.0 257.0 256.0 260 261 262 264 266 149 166 170 240 242 241 243.0 304 287 282 281 280 279 278 277 276 197 Dual specificity mitogen-activated protein kinase kinase 7
STE MAP2K7 MP2K7_HUMAN 5Z1EA O14733 103 419 419.0 95U:60501 Type1 Inactive DFGout 14.5039 12.6055 None -85.05, 151.13 -68.45, -19.93 -71.62, 116.06 181.31, 86.38 78.35, 8.74 in-na in 9.4863 Saltbr-na 6.0011 HRD-in -59.34, -43.5 68.0, 9.1 na-out-none SNCaon out-none ActLoopNT-out 4.5474 ActLoopCT-none nonTYR APEdihe_aaiai APEdist_nnni APE10-dihe-na 999.0, 999.0 APE9-dihe-na 999.0, -160.98 APE8-dihe-in -89.81, 122.82 APE8-rot-na 181.7 APE67-dihe-in -53.89, -34.76 -49.14, -44.64 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-none 999.0 APE9-dist-in 5.0891 None None None XRAY 2.3 0.199 0.283 A 324.0 295.0 21 27 15 12 [[120, 380]] 1.0 5z1e Homo sapiens STE_MAP2K7_HUMAN STE 6.1e-81 277.5 2.0 257.0 256.0 260 261 262 264 266 149 166 170 240 242 241 243.0 304 287 282 281 280 279 278 277 276 197 Dual specificity mitogen-activated protein kinase kinase 7

Ligand: 95U

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