| 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 | MAP4K4 | M4K4_HUMAN | 8V5IA | O95819 | 14 | 309 | 1239.0 | A1AAA:401 | Type1 | Inactive | DFGin | 6.6958 | 14.4044 | BLAminus | -123.5, 178.65 | 60.96, 93.48 | -105.83, 16.81 | 281.58, 81.45 | -85.41, 53.24 | in-in | in | 8.8441 | Saltbr-in | 2.6928 | HRD-in | -57.52, -48.15 | 76.54, -0.01 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -74.03, 127.83 | APE9-dihe-na | -75.65, -135.31 | APE8-dihe-in | -86.64, 138.26 | APE8-rot-out | 184.11 | APE67-dihe-in | -46.08, -37.04 | -88.46, -25.08 | APE12-dist-in | 12.2665 | APE11-dist-in | 11.4862 | APE10-dist-out | 11.2705 | APE9-dist-out | 9.3255 | None | None | None | XRAY | 2.18 | 0.25 | 0.281 | A | 320.0 | 280.0 | 16 | 28 | 18 | 10 | [[25, 289]] | 1.0 | 8v5i | STE_MAP4K4_HUMAN | STE | 1.5e-102 | 348.3 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| STE | MAP4K4 | M4K4_HUMAN | 8V5IB | O95819 | 16 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 16.3982 | 4.7739 | None | -64.57, 130.96 | -143.69, 108.6 | -121.09, 48.4 | 292.52, 92.46 | 85.4, 50.21 | out-out | out | 14.7644 | Saltbr-out | 12.4066 | HRD-in | -69.53, -50.19 | 82.74, -16.12 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9023 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -66.54, -33.43 | APE9-dihe-na | 91.78, -165.44 | APE8-dihe-in | -88.83, 131.09 | APE8-rot-out | 196.95 | APE67-dihe-in | -58.07, -26.81 | -94.4, -14.8 | APE12-dist-out | 18.5475 | APE11-dist-out | 17.2708 | APE10-dist-out | 18.5983 | APE9-dist-out | 9.9307 | None | None | None | XRAY | 2.18 | 0.25 | 0.281 | B | 320.0 | 288.0 | 8 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 8v5i | STE_MAP4K4_HUMAN | STE | 1.5e-102 | 348.3 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| 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 | MAP4K4 | M4K4_HUMAN | 8V5IA | O95819 | 14 | 309 | 1239.0 | A1AAA:401 | Type1 | Inactive | DFGin | 6.6958 | 14.4044 | BLAminus | -123.5, 178.65 | 60.96, 93.48 | -105.83, 16.81 | 281.58, 81.45 | -85.41, 53.24 | in-in | in | 8.8441 | Saltbr-in | 2.6928 | HRD-in | -57.52, -48.15 | 76.54, -0.01 | in-none-out | SNCino | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -74.03, 127.83 | APE9-dihe-na | -75.65, -135.31 | APE8-dihe-in | -86.64, 138.26 | APE8-rot-out | 184.11 | APE67-dihe-in | -46.08, -37.04 | -88.46, -25.08 | APE12-dist-in | 12.2665 | APE11-dist-in | 11.4862 | APE10-dist-out | 11.2705 | APE9-dist-out | 9.3255 | None | None | None | XRAY | 2.18 | 0.25 | 0.281 | A | 320.0 | 280.0 | 16 | 28 | 18 | 10 | [[25, 289]] | 1.0 | 8v5i | Homo sapiens | STE_MAP4K4_HUMAN | STE | 1.5e-102 | 348.3 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| STE | MAP4K4 | M4K4_HUMAN | 8V5IB | O95819 | 16 | 311 | 1239.0 | No_ligand | No_ligand | Inactive | DFGout | 16.3982 | 4.7739 | None | -64.57, 130.96 | -143.69, 108.6 | -121.09, 48.4 | 292.52, 92.46 | 85.4, 50.21 | out-out | out | 14.7644 | Saltbr-out | 12.4066 | HRD-in | -69.53, -50.19 | 82.74, -16.12 | out-out-out | SNCooo | out-out | ActLoopNT-out | 6.9023 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oooo | APE10-dihe-na | -66.54, -33.43 | APE9-dihe-na | 91.78, -165.44 | APE8-dihe-in | -88.83, 131.09 | APE8-rot-out | 196.95 | APE67-dihe-in | -58.07, -26.81 | -94.4, -14.8 | APE12-dist-out | 18.5475 | APE11-dist-out | 17.2708 | APE10-dist-out | 18.5983 | APE9-dist-out | 9.9307 | None | None | None | XRAY | 2.18 | 0.25 | 0.281 | B | 320.0 | 288.0 | 8 | 28 | 28 | 0 | [[25, 289]] | 1.0 | 8v5i | Homo sapiens | STE_MAP4K4_HUMAN | STE | 1.5e-102 | 348.3 | 1.0 | 257.0 | 257.0 | 170 | 171 | 172 | 174 | 176 | 54 | 69 | 73 | 150 | 152 | 151 | 153.0 | 215 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 106 | Mitogen-activated protein kinase kinase kinase kinase 4 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| 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 |
|---|