| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | ROCK1 | ROCK1_HUMAN | 7JOUA | Q13464 | 9 | 402 | 1354.0 | VFS:4000 | Type1 | Inactive | DFGin | 5.9959 | 13.3389 | BLAminus | -143.11, 174.9 | 56.51, 84.53 | -111.27, 42.13 | 313.94, 101.63 | -66.46, -29.86 | in-in | in | 8.5845 | Saltbr-in | 2.6486 | HRD-in | -50.19, -37.76 | 57.05, 15.82 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.2049 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -96.97, 107.53 | APE9-dihe-na | 156.7, 175.62 | APE8-dihe-in | -79.94, 144.48 | APE8-rot-out | 53.34 | APE67-dihe-in | -106.84, -34.67 | -68.39, -2.9 | APE12-dist-in | 11.1521 | APE11-dist-in | 12.0952 | APE10-dist-in | 6.1966 | APE9-dist-in | 3.9409 | None | None | None | XRAY | 3.318 | 0.218 | 0.248 | A | 413.0 | 388.0 | 6 | 29 | 29 | 0 | [[76, 338]] | 1.0 | 7jou | AGC_ROCK1_HUMAN | AGC | 3.5e-94 | 320.7 | 1.0 | 260.0 | 260.0 | 215 | 216 | 217 | 219 | 221 | 105 | 124 | 128 | 195 | 197 | 196 | 198.0 | 260 | 244 | 239 | 238 | 237 | 236 | 235 | 234 | 233 | 154 | Rho-associated protein kinase 1 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVA | O75116 | 25 | 417 | 1388.0 | VFS:502 | Type1 | Inactive | DFGin | 6.2465 | 13.2928 | BLAminus | -141.83, 172.55 | 62.54, 72.12 | -93.6, 17.75 | 301.11, 105.91 | -60.63, -17.81 | in-in | in | 8.505 | Saltbr-in | 2.6448 | HRD-in | -61.37, -48.09 | 70.0, -5.6 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1039 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 128.41 | APE8-rot-out | 35.63 | APE67-dihe-in | -72.9, -30.33 | -60.06, -49.57 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | A | 395.0 | 377.0 | 12 | 29 | 23 | 6 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVB | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2716 | 13.2483 | BLAminus | -142.1, 173.55 | 61.9, 71.69 | -93.43, 17.34 | 301.23, 105.57 | -59.73, -16.68 | in-in | in | 8.5286 | Saltbr-in | 2.6299 | HRD-in | -62.93, -47.02 | 69.4, -4.67 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.0977 | 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 | -66.0, -25.51 | 999.0, -48.59 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | B | 395.0 | 378.0 | 11 | 29 | 21 | 8 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVC | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.2684 | 13.2283 | BLAminus | -142.15, 173.25 | 63.2, 71.86 | -94.04, 16.61 | 301.5, 104.97 | -62.04, -13.94 | in-in | in | 8.3763 | Saltbr-in | 2.7548 | HRD-in | -63.91, -46.28 | 70.58, -6.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.102 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_onno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -148.71 | APE8-dihe-in | -13.99, 103.33 | APE8-rot-out | 49.66 | APE67-dihe-in | -50.5, -34.0 | -98.95, 10.78 | APE12-dist-out | 6.1146 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 9.4434 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | C | 395.0 | 389.0 | 3 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVD | O75116 | 25 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2428 | 13.3572 | BLAminus | -142.23, 173.1 | 61.78, 71.13 | -91.99, 20.3 | 301.3, 105.37 | -69.47, 5.8 | in-in | in | 8.6714 | Saltbr-in | 2.7008 | HRD-in | -54.87, -50.75 | 69.64, -5.46 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1806 | 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, -32.28 | 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 | 2.586 | 0.185 | 0.217 | D | 395.0 | 361.0 | 26 | 29 | 14 | 15 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVE | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2985 | 13.2567 | BLAminus | -140.47, 172.73 | 62.89, 72.53 | -94.4, 16.26 | 301.6, 106.26 | -62.28, -16.19 | in-in | in | 8.4545 | Saltbr-in | 2.7399 | HRD-in | -64.4, -46.2 | 69.9, -8.61 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1263 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_innn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 132.7 | APE8-rot-in | 314.77 | APE67-dihe-in | -47.56, -31.02 | -61.45, -35.46 | APE12-dist-in | 8.281 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | E | 395.0 | 385.0 | 4 | 29 | 26 | 3 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVF | O75116 | 25 | 417 | 1388.0 | VFS:502 | Type1 | Inactive | DFGin | 6.2536 | 13.3298 | BLAminus | -142.21, 173.17 | 67.59, 68.13 | -95.04, 16.84 | 301.9, 107.53 | -61.95, -15.75 | in-in | in | 8.5726 | Saltbr-in | 2.7159 | HRD-in | -62.26, -47.83 | 69.9, -5.26 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0981 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -82.91, 164.49 | APE9-dihe-na | 87.67, 168.25 | APE8-dihe-in | -79.05, 142.33 | APE8-rot-out | 46.7 | APE67-dihe-in | -72.13, -29.81 | -50.42, -43.74 | APE12-dist-in | 8.1458 | APE11-dist-in | 11.7085 | APE10-dist-in | 5.7795 | APE9-dist-in | 4.2858 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | F | 395.0 | 385.0 | 4 | 29 | 29 | 0 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVG | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.268 | 13.2068 | BLAminus | -141.3, 172.73 | 62.62, 71.55 | -93.79, 17.44 | 301.31, 106.61 | -60.9, -17.27 | in-in | in | 8.3572 | Saltbr-in | 2.6194 | HRD-in | -63.54, -47.24 | 68.64, -6.0 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1285 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_innn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 148.83 | APE8-rot-out | 39.24 | APE67-dihe-in | -74.92, -26.36 | -51.82, -46.1 | APE12-dist-in | 10.1264 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | G | 395.0 | 388.0 | 3 | 29 | 26 | 3 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVH | O75116 | 25 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.2783 | 13.2446 | BLAminus | -141.88, 173.26 | 61.58, 72.11 | -93.64, 17.43 | 301.68, 105.86 | -61.63, -15.37 | in-in | in | 8.4613 | Saltbr-in | 2.6636 | HRD-in | -62.24, -47.57 | 69.31, -6.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1108 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -73.76, 175.86 | APE9-dihe-na | 74.79, 179.62 | APE8-dihe-in | -84.69, 144.58 | APE8-rot-out | 45.29 | APE67-dihe-in | -73.44, -28.15 | -53.28, -43.42 | APE12-dist-in | 8.553 | APE11-dist-in | 11.9866 | APE10-dist-in | 5.9693 | APE9-dist-in | 4.3451 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | H | 395.0 | 386.0 | 4 | 29 | 29 | 0 | [[92, 354]] | 1.0 | 7jov | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | ROCK1 | ROCK1_HUMAN | 7JOUA | Q13464 | 9 | 402 | 1354.0 | VFS:4000 | Type1 | Inactive | DFGin | 5.9959 | 13.3389 | BLAminus | -143.11, 174.9 | 56.51, 84.53 | -111.27, 42.13 | 313.94, 101.63 | -66.46, -29.86 | in-in | in | 8.5845 | Saltbr-in | 2.6486 | HRD-in | -50.19, -37.76 | 57.05, 15.82 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.2049 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -96.97, 107.53 | APE9-dihe-na | 156.7, 175.62 | APE8-dihe-in | -79.94, 144.48 | APE8-rot-out | 53.34 | APE67-dihe-in | -106.84, -34.67 | -68.39, -2.9 | APE12-dist-in | 11.1521 | APE11-dist-in | 12.0952 | APE10-dist-in | 6.1966 | APE9-dist-in | 3.9409 | None | None | None | XRAY | 3.318 | 0.218 | 0.248 | A | 413.0 | 388.0 | 6 | 29 | 29 | 0 | [[76, 338]] | 1.0 | 7jou | Homo sapiens | AGC_ROCK1_HUMAN | AGC | 3.5e-94 | 320.7 | 1.0 | 260.0 | 260.0 | 215 | 216 | 217 | 219 | 221 | 105 | 124 | 128 | 195 | 197 | 196 | 198.0 | 260 | 244 | 239 | 238 | 237 | 236 | 235 | 234 | 233 | 154 | Rho-associated protein kinase 1 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVA | O75116 | 25 | 417 | 1388.0 | VFS:502 | Type1 | Inactive | DFGin | 6.2465 | 13.2928 | BLAminus | -141.83, 172.55 | 62.54, 72.12 | -93.6, 17.75 | 301.11, 105.91 | -60.63, -17.81 | in-in | in | 8.505 | Saltbr-in | 2.6448 | HRD-in | -61.37, -48.09 | 70.0, -5.6 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1039 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 128.41 | APE8-rot-out | 35.63 | APE67-dihe-in | -72.9, -30.33 | -60.06, -49.57 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | A | 395.0 | 377.0 | 12 | 29 | 23 | 6 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVB | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2716 | 13.2483 | BLAminus | -142.1, 173.55 | 61.9, 71.69 | -93.43, 17.34 | 301.23, 105.57 | -59.73, -16.68 | in-in | in | 8.5286 | Saltbr-in | 2.6299 | HRD-in | -62.93, -47.02 | 69.4, -4.67 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.0977 | 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 | -66.0, -25.51 | 999.0, -48.59 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | B | 395.0 | 378.0 | 11 | 29 | 21 | 8 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVC | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.2684 | 13.2283 | BLAminus | -142.15, 173.25 | 63.2, 71.86 | -94.04, 16.61 | 301.5, 104.97 | -62.04, -13.94 | in-in | in | 8.3763 | Saltbr-in | 2.7548 | HRD-in | -63.91, -46.28 | 70.58, -6.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.102 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_onno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -148.71 | APE8-dihe-in | -13.99, 103.33 | APE8-rot-out | 49.66 | APE67-dihe-in | -50.5, -34.0 | -98.95, 10.78 | APE12-dist-out | 6.1146 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 9.4434 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | C | 395.0 | 389.0 | 3 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVD | O75116 | 25 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2428 | 13.3572 | BLAminus | -142.23, 173.1 | 61.78, 71.13 | -91.99, 20.3 | 301.3, 105.37 | -69.47, 5.8 | in-in | in | 8.6714 | Saltbr-in | 2.7008 | HRD-in | -54.87, -50.75 | 69.64, -5.46 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1806 | 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, -32.28 | 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 | 2.586 | 0.185 | 0.217 | D | 395.0 | 361.0 | 26 | 29 | 14 | 15 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVE | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | None | DFGin | 6.2985 | 13.2567 | BLAminus | -140.47, 172.73 | 62.89, 72.53 | -94.4, 16.26 | 301.6, 106.26 | -62.28, -16.19 | in-in | in | 8.4545 | Saltbr-in | 2.7399 | HRD-in | -64.4, -46.2 | 69.9, -8.61 | in-in-none | SNCiin | in-none | ActLoopNT-in | 3.1263 | ActLoopCT-none | nonTYR | APEdihe_aanii | APEdist_innn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 132.7 | APE8-rot-in | 314.77 | APE67-dihe-in | -47.56, -31.02 | -61.45, -35.46 | APE12-dist-in | 8.281 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | E | 395.0 | 385.0 | 4 | 29 | 26 | 3 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVF | O75116 | 25 | 417 | 1388.0 | VFS:502 | Type1 | Inactive | DFGin | 6.2536 | 13.3298 | BLAminus | -142.21, 173.17 | 67.59, 68.13 | -95.04, 16.84 | 301.9, 107.53 | -61.95, -15.75 | in-in | in | 8.5726 | Saltbr-in | 2.7159 | HRD-in | -62.26, -47.83 | 69.9, -5.26 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.0981 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -82.91, 164.49 | APE9-dihe-na | 87.67, 168.25 | APE8-dihe-in | -79.05, 142.33 | APE8-rot-out | 46.7 | APE67-dihe-in | -72.13, -29.81 | -50.42, -43.74 | APE12-dist-in | 8.1458 | APE11-dist-in | 11.7085 | APE10-dist-in | 5.7795 | APE9-dist-in | 4.2858 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | F | 395.0 | 385.0 | 4 | 29 | 29 | 0 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVG | O75116 | 23 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.268 | 13.2068 | BLAminus | -141.3, 172.73 | 62.62, 71.55 | -93.79, 17.44 | 301.31, 106.61 | -60.9, -17.27 | in-in | in | 8.3572 | Saltbr-in | 2.6194 | HRD-in | -63.54, -47.24 | 68.64, -6.0 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1285 | ActLoopCT-out | nonTYR | APEdihe_aanoi | APEdist_innn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 148.83 | APE8-rot-out | 39.24 | APE67-dihe-in | -74.92, -26.36 | -51.82, -46.1 | APE12-dist-in | 10.1264 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | G | 395.0 | 388.0 | 3 | 29 | 26 | 3 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated protein kinase 2 |
| AGC | ROCK2 | ROCK2_HUMAN | 7JOVH | O75116 | 25 | 417 | 1388.0 | VFS:501 | Type1 | Inactive | DFGin | 6.2783 | 13.2446 | BLAminus | -141.88, 173.26 | 61.58, 72.11 | -93.64, 17.43 | 301.68, 105.86 | -61.63, -15.37 | in-in | in | 8.4613 | Saltbr-in | 2.6636 | HRD-in | -62.24, -47.57 | 69.31, -6.43 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.1108 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -73.76, 175.86 | APE9-dihe-na | 74.79, 179.62 | APE8-dihe-in | -84.69, 144.58 | APE8-rot-out | 45.29 | APE67-dihe-in | -73.44, -28.15 | -53.28, -43.42 | APE12-dist-in | 8.553 | APE11-dist-in | 11.9866 | APE10-dist-in | 5.9693 | APE9-dist-in | 4.3451 | None | None | None | XRAY | 2.586 | 0.185 | 0.217 | H | 395.0 | 386.0 | 4 | 29 | 29 | 0 | [[92, 354]] | 1.0 | 7jov | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.2e-93 | 318.1 | 1.0 | 260.0 | 260.0 | 231 | 232 | 233 | 235 | 237 | 121 | 140 | 144 | 211 | 213 | 212 | 214.0 | 276 | 260 | 255 | 254 | 253 | 252 | 251 | 250 | 249 | 170 | Rho-associated 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 |
|---|