| 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 | 6OYWA | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Active | DFGin | 6.4341 | 14.086 | BLAminus | -125.84, 170.11 | 63.72, 92.65 | -105.14, 20.43 | 292.62, 91.43 | -65.77, -22.03 | in-in | in | 8.8219 | Saltbr-in | 2.7422 | HRD-in | -80.43, -46.73 | 68.52, 12.61 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.933 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -121.72, -53.83 | APE9-dihe-na | -69.9, -156.1 | APE8-dihe-in | -92.5, 138.42 | APE8-rot-in | 305.47 | APE67-dihe-in | -70.77, -12.46 | -57.12, -50.56 | APE12-dist-in | 9.3372 | APE11-dist-in | 11.4953 | APE10-dist-in | 5.7726 | APE9-dist-in | 3.3641 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | A | 294.0 | 261.0 | 8 | 28 | 23 | 5 | [[678, 938]] | 1.0 | 6oyw | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWB | Q99683 | 671 | 940 | 1374.0 | NKJ:1001 | Type1 | Inactive | DFGin | 6.6897 | 13.8676 | BLAminus | -122.51, 166.6 | 60.27, 92.71 | -105.19, 18.97 | 297.73, 95.21 | -67.14, -20.88 | in-in | in | 8.5731 | Saltbr-in | 2.696 | HRD-in | -76.18, -44.1 | 70.51, 11.85 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1859 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnoi | APE10-dihe-na | 999.0, 104.69 | APE9-dihe-na | -71.78, -150.4 | APE8-dihe-in | -87.95, 134.15 | APE8-rot-in | 310.76 | APE67-dihe-in | -70.38, -10.89 | -59.89, -50.46 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 10.1315 | APE9-dist-in | 3.937 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | B | 294.0 | 256.0 | 14 | 28 | 18 | 10 | [[678, 938]] | 1.0 | 6oyw | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWC | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Inactive | DFGin | 6.8217 | 14.1935 | BLAminus | -125.99, 170.88 | 63.72, 91.25 | -105.44, 18.69 | 294.07, 95.01 | -66.78, -18.88 | in-in | in | 8.8295 | Saltbr-in | 2.6138 | HRD-in | -80.6, -45.91 | 69.98, 10.62 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8552 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -133.5, 148.17 | APE9-dihe-na | -70.3, -155.77 | APE8-dihe-in | -88.98, 138.74 | APE8-rot-out | 85.39 | APE67-dihe-in | -67.74, -14.04 | -56.79, -47.02 | APE12-dist-in | 10.9845 | APE11-dist-out | 6.0323 | APE10-dist-out | 10.2363 | APE9-dist-in | 3.6751 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | C | 294.0 | 260.0 | 9 | 28 | 23 | 5 | [[678, 938]] | 1.0 | 6oyw | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWD | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Active | DFGin | 6.7296 | 14.0996 | BLAminus | -126.38, 171.59 | 64.38, 91.17 | -105.76, 19.88 | 291.74, 93.18 | -66.55, -21.17 | in-in | in | 8.5701 | Saltbr-in | 2.6149 | HRD-in | -79.44, -46.61 | 68.22, 12.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0809 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.59, -53.64 | APE9-dihe-na | -69.48, -155.47 | APE8-dihe-in | -94.08, 138.29 | APE8-rot-in | 307.43 | APE67-dihe-in | -70.62, -12.36 | -58.47, -50.51 | APE12-dist-in | 9.6166 | APE11-dist-in | 11.1803 | APE10-dist-in | 5.582 | APE9-dist-in | 3.2492 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | D | 294.0 | 260.0 | 9 | 28 | 21 | 7 | [[678, 938]] | 1.0 | 6oyw | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 |
| 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 | 6OYWA | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Active | DFGin | 6.4341 | 14.086 | BLAminus | -125.84, 170.11 | 63.72, 92.65 | -105.14, 20.43 | 292.62, 91.43 | -65.77, -22.03 | in-in | in | 8.8219 | Saltbr-in | 2.7422 | HRD-in | -80.43, -46.73 | 68.52, 12.61 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.933 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -121.72, -53.83 | APE9-dihe-na | -69.9, -156.1 | APE8-dihe-in | -92.5, 138.42 | APE8-rot-in | 305.47 | APE67-dihe-in | -70.77, -12.46 | -57.12, -50.56 | APE12-dist-in | 9.3372 | APE11-dist-in | 11.4953 | APE10-dist-in | 5.7726 | APE9-dist-in | 3.3641 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | A | 294.0 | 261.0 | 8 | 28 | 23 | 5 | [[678, 938]] | 1.0 | 6oyw | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWB | Q99683 | 671 | 940 | 1374.0 | NKJ:1001 | Type1 | Inactive | DFGin | 6.6897 | 13.8676 | BLAminus | -122.51, 166.6 | 60.27, 92.71 | -105.19, 18.97 | 297.73, 95.21 | -67.14, -20.88 | in-in | in | 8.5731 | Saltbr-in | 2.696 | HRD-in | -76.18, -44.1 | 70.51, 11.85 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1859 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_nnoi | APE10-dihe-na | 999.0, 104.69 | APE9-dihe-na | -71.78, -150.4 | APE8-dihe-in | -87.95, 134.15 | APE8-rot-in | 310.76 | APE67-dihe-in | -70.38, -10.89 | -59.89, -50.46 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 10.1315 | APE9-dist-in | 3.937 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | B | 294.0 | 256.0 | 14 | 28 | 18 | 10 | [[678, 938]] | 1.0 | 6oyw | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWC | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Inactive | DFGin | 6.8217 | 14.1935 | BLAminus | -125.99, 170.88 | 63.72, 91.25 | -105.44, 18.69 | 294.07, 95.01 | -66.78, -18.88 | in-in | in | 8.8295 | Saltbr-in | 2.6138 | HRD-in | -80.6, -45.91 | 69.98, 10.62 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8552 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -133.5, 148.17 | APE9-dihe-na | -70.3, -155.77 | APE8-dihe-in | -88.98, 138.74 | APE8-rot-out | 85.39 | APE67-dihe-in | -67.74, -14.04 | -56.79, -47.02 | APE12-dist-in | 10.9845 | APE11-dist-out | 6.0323 | APE10-dist-out | 10.2363 | APE9-dist-in | 3.6751 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | C | 294.0 | 260.0 | 9 | 28 | 23 | 5 | [[678, 938]] | 1.0 | 6oyw | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 | 6OYWD | Q99683 | 671 | 939 | 1374.0 | NKJ:1001 | Type1 | Active | DFGin | 6.7296 | 14.0996 | BLAminus | -126.38, 171.59 | 64.38, 91.17 | -105.76, 19.88 | 291.74, 93.18 | -66.55, -21.17 | in-in | in | 8.5701 | Saltbr-in | 2.6149 | HRD-in | -79.44, -46.61 | 68.22, 12.5 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0809 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.59, -53.64 | APE9-dihe-na | -69.48, -155.47 | APE8-dihe-in | -94.08, 138.29 | APE8-rot-in | 307.43 | APE67-dihe-in | -70.62, -12.36 | -58.47, -50.51 | APE12-dist-in | 9.6166 | APE11-dist-in | 11.1803 | APE10-dist-in | 5.582 | APE9-dist-in | 3.2492 | T838E | None | None | XRAY | 2.603 | 0.21 | 0.255 | D | 294.0 | 260.0 | 9 | 28 | 21 | 7 | [[678, 938]] | 1.0 | 6oyw | Homo sapiens | STE_MAP3K5_HUMAN | STE | 1.2e-80 | 276.6 | 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 |
| 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 |
|---|