| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | MAPKAPK2 | MAPK2_HUMAN | 2ONLC | P49137 | 46 | 393 | 400.0 | No_ligand | No_ligand | Inactive | DFGin | 5.3716 | 13.8775 | BLAminus | -144.71, 177.23 | 57.74, 79.95 | -93.42, 20.24 | 283.94, 44.28 | -42.17, -30.27 | out-out | out | 10.4822 | Saltbr-out | 5.1589 | HRD-in | -63.93, -50.35 | 64.99, 1.87 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6783 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -145.05, 148.13 | APE9-dihe-na | -79.09, -172.22 | APE8-dihe-out | -151.58, -163.46 | APE8-rot-in | 293.27 | APE67-dihe-out | -61.73, 102.69 | -87.71, -35.23 | APE12-dist-out | 31.6639 | APE11-dist-out | 35.028 | APE10-dist-out | 35.9403 | APE9-dist-out | 30.1458 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | C | 406.0 | 317.0 | 31 | 27 | 27 | 0 | [[63, 325]] | 1.0 | 2onl | CAMK_MAPKAPK2_HUMAN | CAMK | 7e-80 | 274.2 | 3.0 | 256.0 | 254.0 | 206 | 207 | 208 | 210 | 212 | 93 | 104 | 108 | 183 | 185 | 184 | 186.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 139 | MAP kinase-activated protein kinase 2 |
| CAMK | MAPKAPK2 | MAPK2_HUMAN | 2ONLD | P49137 | 46 | 393 | 400.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2247 | 13.8481 | BLAminus | -137.37, 177.77 | 67.14, 69.15 | -84.34, 79.92 | 286.72, 38.57 | -108.36, -19.15 | out-out | out | 11.0046 | Saltbr-out | 7.4082 | HRD-out | -59.16, 114.42 | -89.49, -17.7 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.5955 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_oooo | APE10-dihe-na | -152.0, 123.99 | APE9-dihe-na | -67.05, 173.86 | APE8-dihe-out | -109.94, -76.7 | APE8-rot-out | 147.79 | APE67-dihe-out | -164.84, -165.18 | -122.96, 14.75 | APE12-dist-out | 31.0185 | APE11-dist-out | 34.1961 | APE10-dist-out | 36.3708 | APE9-dist-out | 29.9024 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | D | 406.0 | 313.0 | 35 | 27 | 27 | 0 | [[63, 325]] | 1.0 | 2onl | CAMK_MAPKAPK2_HUMAN | CAMK | 7e-80 | 274.2 | 3.0 | 256.0 | 254.0 | 206 | 207 | 208 | 210 | 212 | 93 | 104 | 108 | 183 | 185 | 184 | 186.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 139 | MAP kinase-activated protein kinase 2 |
| CMGC | MAPK14 | MK14_HUMAN | 2ONLA | Q16539 | 4 | 352 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 7.2877 | 16.1056 | BLBminus | -139.8, -177.93 | 43.34, 77.4 | -75.22, 146.44 | 290.54, 41.49 | -62.95, 116.48 | in-in | in | 9.4516 | Saltbr-in | 2.6513 | HRD-in | -52.0, -56.17 | 74.39, -2.78 | in-out-none | SNCion | out-none | ActLoopNT-out | 9.1471 | ActLoopCT-none | nonTYR | APEdihe_aanni | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 49.36 | APE8-rot-none | 999.0 | APE67-dihe-in | -86.46, -33.32 | -110.87, 9.1 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | A | 366.0 | 338.0 | 11 | 25 | 14 | 11 | [[24, 308]] | 1.0 | 2onl | CMGC_MAPK14_HUMAN | CMGC | 6.2e-85 | 291.1 | 1.0 | 301.0 | 301.0 | 167 | 168 | 169 | 171 | 173 | 53 | 71 | 75 | 147 | 149 | 148 | 150.0 | 205 | 192 | 187 | 186 | 185 | 184 | 183 | 182 | 181 | 107 | Mitogen-activated protein kinase 14 |
| CMGC | MAPK14 | MK14_HUMAN | 2ONLB | Q16539 | 4 | 352 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 7.3212 | 16.1634 | BLBminus | -141.81, -179.23 | 45.19, 76.7 | -75.31, 145.49 | 288.03, 42.26 | -62.52, 115.05 | in-in | in | 9.4911 | Saltbr-in | 2.8294 | HRD-in | -52.05, -57.26 | 76.3, -1.57 | in-out-out | SNCioo | out-out | ActLoopNT-out | 9.1161 | ActLoopCT-out | nonTYR | APEdihe_aaoni | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -126.14 | APE8-dihe-out | -128.48, 30.34 | APE8-rot-none | 999.0 | APE67-dihe-in | -39.69, -33.92 | -99.79, -26.07 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 13.1744 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | B | 366.0 | 339.0 | 10 | 25 | 15 | 10 | [[24, 308]] | 1.0 | 2onl | CMGC_MAPK14_HUMAN | CMGC | 6.2e-85 | 291.1 | 1.0 | 301.0 | 301.0 | 167 | 168 | 169 | 171 | 173 | 53 | 71 | 75 | 147 | 149 | 148 | 150.0 | 205 | 192 | 187 | 186 | 185 | 184 | 183 | 182 | 181 | 107 | Mitogen-activated protein kinase 14 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | MAPKAPK2 | MAPK2_HUMAN | 2ONLC | P49137 | 46 | 393 | 400.0 | No_ligand | No_ligand | Inactive | DFGin | 5.3716 | 13.8775 | BLAminus | -144.71, 177.23 | 57.74, 79.95 | -93.42, 20.24 | 283.94, 44.28 | -42.17, -30.27 | out-out | out | 10.4822 | Saltbr-out | 5.1589 | HRD-in | -63.93, -50.35 | 64.99, 1.87 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.6783 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -145.05, 148.13 | APE9-dihe-na | -79.09, -172.22 | APE8-dihe-out | -151.58, -163.46 | APE8-rot-in | 293.27 | APE67-dihe-out | -61.73, 102.69 | -87.71, -35.23 | APE12-dist-out | 31.6639 | APE11-dist-out | 35.028 | APE10-dist-out | 35.9403 | APE9-dist-out | 30.1458 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | C | 406.0 | 317.0 | 31 | 27 | 27 | 0 | [[63, 325]] | 1.0 | 2onl | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 7e-80 | 274.2 | 3.0 | 256.0 | 254.0 | 206 | 207 | 208 | 210 | 212 | 93 | 104 | 108 | 183 | 185 | 184 | 186.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 139 | MAP kinase-activated protein kinase 2 |
| CAMK | MAPKAPK2 | MAPK2_HUMAN | 2ONLD | P49137 | 46 | 393 | 400.0 | No_ligand | No_ligand | Inactive | DFGin | 4.2247 | 13.8481 | BLAminus | -137.37, 177.77 | 67.14, 69.15 | -84.34, 79.92 | 286.72, 38.57 | -108.36, -19.15 | out-out | out | 11.0046 | Saltbr-out | 7.4082 | HRD-out | -59.16, 114.42 | -89.49, -17.7 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.5955 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_oooo | APE10-dihe-na | -152.0, 123.99 | APE9-dihe-na | -67.05, 173.86 | APE8-dihe-out | -109.94, -76.7 | APE8-rot-out | 147.79 | APE67-dihe-out | -164.84, -165.18 | -122.96, 14.75 | APE12-dist-out | 31.0185 | APE11-dist-out | 34.1961 | APE10-dist-out | 36.3708 | APE9-dist-out | 29.9024 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | D | 406.0 | 313.0 | 35 | 27 | 27 | 0 | [[63, 325]] | 1.0 | 2onl | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 7e-80 | 274.2 | 3.0 | 256.0 | 254.0 | 206 | 207 | 208 | 210 | 212 | 93 | 104 | 108 | 183 | 185 | 184 | 186.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 139 | MAP kinase-activated protein kinase 2 |
| CMGC | MAPK14 | MK14_HUMAN | 2ONLA | Q16539 | 4 | 352 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 7.2877 | 16.1056 | BLBminus | -139.8, -177.93 | 43.34, 77.4 | -75.22, 146.44 | 290.54, 41.49 | -62.95, 116.48 | in-in | in | 9.4516 | Saltbr-in | 2.6513 | HRD-in | -52.0, -56.17 | 74.39, -2.78 | in-out-none | SNCion | out-none | ActLoopNT-out | 9.1471 | ActLoopCT-none | nonTYR | APEdihe_aanni | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 49.36 | APE8-rot-none | 999.0 | APE67-dihe-in | -86.46, -33.32 | -110.87, 9.1 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | A | 366.0 | 338.0 | 11 | 25 | 14 | 11 | [[24, 308]] | 1.0 | 2onl | Homo sapiens | CMGC_MAPK14_HUMAN | CMGC | 6.2e-85 | 291.1 | 1.0 | 301.0 | 301.0 | 167 | 168 | 169 | 171 | 173 | 53 | 71 | 75 | 147 | 149 | 148 | 150.0 | 205 | 192 | 187 | 186 | 185 | 184 | 183 | 182 | 181 | 107 | Mitogen-activated protein kinase 14 |
| CMGC | MAPK14 | MK14_HUMAN | 2ONLB | Q16539 | 4 | 352 | 360.0 | No_ligand | No_ligand | Inactive | DFGin | 7.3212 | 16.1634 | BLBminus | -141.81, -179.23 | 45.19, 76.7 | -75.31, 145.49 | 288.03, 42.26 | -62.52, 115.05 | in-in | in | 9.4911 | Saltbr-in | 2.8294 | HRD-in | -52.05, -57.26 | 76.3, -1.57 | in-out-out | SNCioo | out-out | ActLoopNT-out | 9.1161 | ActLoopCT-out | nonTYR | APEdihe_aaoni | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -126.14 | APE8-dihe-out | -128.48, 30.34 | APE8-rot-none | 999.0 | APE67-dihe-in | -39.69, -33.92 | -99.79, -26.07 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 13.1744 | None | None | None | XRAY | 4.0 | 0.315 | 0.331 | B | 366.0 | 339.0 | 10 | 25 | 15 | 10 | [[24, 308]] | 1.0 | 2onl | Homo sapiens | CMGC_MAPK14_HUMAN | CMGC | 6.2e-85 | 291.1 | 1.0 | 301.0 | 301.0 | 167 | 168 | 169 | 171 | 173 | 53 | 71 | 75 | 147 | 149 | 148 | 150.0 | 205 | 192 | 187 | 186 | 185 | 184 | 183 | 182 | 181 | 107 | Mitogen-activated protein kinase 14 |
| 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 |
|---|