| 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 | 3A2CA | P49137 | 47 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 5.0144 | 14.1985 | BLAminus | -114.29, 177.7 | 65.08, 82.59 | -97.76, 30.04 | 283.71, 62.65 | -83.2, 2.17 | in-in | in | 9.6031 | Saltbr-in | 2.8959 | HRD-in | -71.23, -50.47 | 72.84, 4.07 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8244 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | A | 324.0 | 274.0 | 24 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CB | P49137 | 47 | 345 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | Inactive | DFGin | 4.737 | 13.5535 | BLAminus | -125.31, 179.32 | 62.03, 93.3 | -105.16, 21.09 | 287.49, 59.11 | -59.5, -21.99 | in-out | in | 9.2971 | Saltbr-out | 4.1573 | HRD-in | -77.44, -36.26 | 59.31, 7.54 | out-in-none | SNCoin | in-none | ActLoopNT-in | 3.0189 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | B | 324.0 | 277.0 | 22 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CC | P49137 | 48 | 342 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7156 | 14.2562 | BLAminus | -128.21, 173.02 | 63.81, 82.24 | -94.68, 28.25 | 283.43, 68.99 | -82.34, 1.06 | in-in | in | 9.5905 | Saltbr-in | 3.278 | HRD-in | -77.67, -40.68 | 59.71, 0.01 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.7214 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | C | 324.0 | 273.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CD | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8069 | 14.0504 | BLAminus | -134.61, 177.48 | 60.17, 88.04 | -99.2, 27.01 | 287.17, 57.58 | -68.85, -16.25 | in-in | in | 9.5161 | Saltbr-in | 3.3906 | HRD-in | -71.25, -48.29 | 67.38, -0.24 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8934 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | D | 324.0 | 277.0 | 20 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CE | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8114 | 14.4939 | BLAminus | -118.71, 175.79 | 66.97, 85.41 | -100.83, 39.75 | 283.04, 64.41 | -78.69, -21.27 | in-in | in | 9.8825 | Saltbr-in | 3.2465 | HRD-in | -75.69, -51.67 | 70.77, 11.52 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8814 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | E | 324.0 | 276.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CF | P49137 | 47 | 345 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.6287 | 13.8028 | BLAminus | -127.88, 179.32 | 59.24, 93.48 | -106.61, 16.66 | 278.85, 67.85 | -68.32, 3.18 | in-in | in | 9.1272 | Saltbr-in | 2.6994 | HRD-in | -69.45, -47.69 | 65.57, 9.98 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9449 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | F | 324.0 | 287.0 | 12 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CG | P49137 | 48 | 342 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8762 | 13.8357 | BLAminus | -119.34, 176.47 | 66.35, 96.55 | -109.04, 20.64 | 281.55, 64.63 | -61.28, -15.4 | in-in | in | 9.1812 | Saltbr-in | 2.8373 | HRD-in | -65.24, -45.15 | 65.73, 3.99 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1605 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | G | 324.0 | 273.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CH | P49137 | 47 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7438 | 14.0931 | BLAminus | -121.63, 176.48 | 63.37, 90.03 | -101.58, 35.19 | 280.13, 69.73 | -76.98, -23.87 | in-in | in | 9.4429 | Saltbr-in | 2.813 | HRD-in | -82.97, -49.71 | 72.47, 4.66 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8749 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | H | 324.0 | 275.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CI | P49137 | 48 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | Inactive | DFGin | 4.809 | 13.7204 | BLAminus | -125.53, 174.35 | 66.59, 96.73 | -108.15, 23.97 | 284.55, 62.17 | -70.07, 2.45 | in-out | in | 9.2806 | Saltbr-out | 4.7521 | HRD-in | -79.24, -45.58 | 66.95, 0.2 | out-in-none | SNCoin | in-none | ActLoopNT-in | 2.9399 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | I | 324.0 | 275.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CJ | P49137 | 48 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 5.134 | 14.2394 | BLAminus | -131.68, 169.07 | 71.74, 90.49 | -103.64, 47.99 | 277.77, 64.09 | -101.18, 2.5 | in-in | in | 9.2675 | Saltbr-in | 2.955 | HRD-in | -70.85, -53.4 | 79.34, -2.41 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.2335 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | J | 324.0 | 275.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CK | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7844 | 13.6875 | BLAminus | -132.3, 173.04 | 63.29, 100.11 | -111.51, 35.65 | 282.7, 65.16 | -83.49, -1.19 | in-in | in | 9.3915 | Saltbr-in | 2.7797 | HRD-in | -81.49, -46.78 | 68.74, 4.82 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9394 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | K | 324.0 | 273.0 | 24 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CL | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.9203 | 14.3196 | BLAminus | -139.15, 172.7 | 64.17, 88.89 | -98.58, 16.8 | 276.6, 62.53 | -69.99, 7.3 | in-in | in | 9.404 | Saltbr-in | 3.5756 | HRD-in | -76.45, -46.65 | 74.85, -9.83 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9655 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | L | 324.0 | 276.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 |
| 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 | 3A2CA | P49137 | 47 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 5.0144 | 14.1985 | BLAminus | -114.29, 177.7 | 65.08, 82.59 | -97.76, 30.04 | 283.71, 62.65 | -83.2, 2.17 | in-in | in | 9.6031 | Saltbr-in | 2.8959 | HRD-in | -71.23, -50.47 | 72.84, 4.07 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8244 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | A | 324.0 | 274.0 | 24 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CB | P49137 | 47 | 345 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | Inactive | DFGin | 4.737 | 13.5535 | BLAminus | -125.31, 179.32 | 62.03, 93.3 | -105.16, 21.09 | 287.49, 59.11 | -59.5, -21.99 | in-out | in | 9.2971 | Saltbr-out | 4.1573 | HRD-in | -77.44, -36.26 | 59.31, 7.54 | out-in-none | SNCoin | in-none | ActLoopNT-in | 3.0189 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | B | 324.0 | 277.0 | 22 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CC | P49137 | 48 | 342 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7156 | 14.2562 | BLAminus | -128.21, 173.02 | 63.81, 82.24 | -94.68, 28.25 | 283.43, 68.99 | -82.34, 1.06 | in-in | in | 9.5905 | Saltbr-in | 3.278 | HRD-in | -77.67, -40.68 | 59.71, 0.01 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.7214 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | C | 324.0 | 273.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CD | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8069 | 14.0504 | BLAminus | -134.61, 177.48 | 60.17, 88.04 | -99.2, 27.01 | 287.17, 57.58 | -68.85, -16.25 | in-in | in | 9.5161 | Saltbr-in | 3.3906 | HRD-in | -71.25, -48.29 | 67.38, -0.24 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8934 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | D | 324.0 | 277.0 | 20 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CE | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8114 | 14.4939 | BLAminus | -118.71, 175.79 | 66.97, 85.41 | -100.83, 39.75 | 283.04, 64.41 | -78.69, -21.27 | in-in | in | 9.8825 | Saltbr-in | 3.2465 | HRD-in | -75.69, -51.67 | 70.77, 11.52 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8814 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | E | 324.0 | 276.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CF | P49137 | 47 | 345 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.6287 | 13.8028 | BLAminus | -127.88, 179.32 | 59.24, 93.48 | -106.61, 16.66 | 278.85, 67.85 | -68.32, 3.18 | in-in | in | 9.1272 | Saltbr-in | 2.6994 | HRD-in | -69.45, -47.69 | 65.57, 9.98 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9449 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | F | 324.0 | 287.0 | 12 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CG | P49137 | 48 | 342 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.8762 | 13.8357 | BLAminus | -119.34, 176.47 | 66.35, 96.55 | -109.04, 20.64 | 281.55, 64.63 | -61.28, -15.4 | in-in | in | 9.1812 | Saltbr-in | 2.8373 | HRD-in | -65.24, -45.15 | 65.73, 3.99 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1605 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | G | 324.0 | 273.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CH | P49137 | 47 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7438 | 14.0931 | BLAminus | -121.63, 176.48 | 63.37, 90.03 | -101.58, 35.19 | 280.13, 69.73 | -76.98, -23.87 | in-in | in | 9.4429 | Saltbr-in | 2.813 | HRD-in | -82.97, -49.71 | 72.47, 4.66 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.8749 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | H | 324.0 | 275.0 | 22 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CI | P49137 | 48 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | Inactive | DFGin | 4.809 | 13.7204 | BLAminus | -125.53, 174.35 | 66.59, 96.73 | -108.15, 23.97 | 284.55, 62.17 | -70.07, 2.45 | in-out | in | 9.2806 | Saltbr-out | 4.7521 | HRD-in | -79.24, -45.58 | 66.95, 0.2 | out-in-none | SNCoin | in-none | ActLoopNT-in | 2.9399 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | I | 324.0 | 275.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CJ | P49137 | 48 | 343 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 5.134 | 14.2394 | BLAminus | -131.68, 169.07 | 71.74, 90.49 | -103.64, 47.99 | 277.77, 64.09 | -101.18, 2.5 | in-in | in | 9.2675 | Saltbr-in | 2.955 | HRD-in | -70.85, -53.4 | 79.34, -2.41 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.2335 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | J | 324.0 | 275.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CK | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.7844 | 13.6875 | BLAminus | -132.3, 173.04 | 63.29, 100.11 | -111.51, 35.65 | 282.7, 65.16 | -83.49, -1.19 | in-in | in | 9.3915 | Saltbr-in | 2.7797 | HRD-in | -81.49, -46.78 | 68.74, 4.82 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9394 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | K | 324.0 | 273.0 | 24 | 27 | 14 | 13 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 | 3A2CL | P49137 | 48 | 344 | 400.0 | PDY:1,PDY:2 | Type1,Allosteric | None | DFGin | 4.9203 | 14.3196 | BLAminus | -139.15, 172.7 | 64.17, 88.89 | -98.58, 16.8 | 276.6, 62.53 | -69.99, 7.3 | in-in | in | 9.404 | Saltbr-in | 3.5756 | HRD-in | -76.45, -46.65 | 74.85, -9.83 | in-in-none | SNCiin | in-none | ActLoopNT-in | 2.9655 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | 999.0, 999.0 | 999.0, 999.0 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.9 | 0.288 | 0.335 | L | 324.0 | 276.0 | 21 | 27 | 15 | 12 | [[63, 325]] | 1.0 | 3a2c | Homo sapiens | CAMK_MAPKAPK2_HUMAN | CAMK | 3.4e-80 | 275.0 | 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 |
| 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 |
|---|