| 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 | ROCK2 | ROCK2_HUMAN | 7P6QA | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.3544 | 13.3521 | BLAminus | -144.62, 167.8 | 60.55, 87.07 | -103.28, 32.93 | 301.59, 102.75 | -70.91, -20.49 | in-in | in | 8.6243 | Saltbr-in | 2.7039 | HRD-in | -68.26, -48.48 | 72.01, -4.52 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.994 | 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, 127.2 | APE8-rot-out | 61.47 | APE67-dihe-in | -43.02, -40.39 | -80.11, -25.58 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | A | 399.0 | 377.0 | 13 | 29 | 17 | 12 | [[92, 354]] | 1.0 | 7p6q | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QB | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.3 | 13.3089 | BLAminus | -144.44, 167.29 | 60.61, 86.93 | -103.67, 32.19 | 301.37, 101.58 | -69.29, -21.55 | in-in | in | 8.6066 | Saltbr-in | 2.913 | HRD-in | -66.9, -49.14 | 71.14, -2.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9639 | 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, 125.87 | APE8-rot-out | 59.05 | APE67-dihe-in | -44.93, -40.33 | -80.35, -26.21 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | B | 399.0 | 374.0 | 15 | 29 | 17 | 12 | [[92, 354]] | 1.0 | 7p6q | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QC | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.2846 | 13.3478 | BLAminus | -141.89, 172.56 | 57.11, 86.76 | -103.5, 32.32 | 300.6, 102.23 | -70.12, -20.17 | in-in | in | 8.6371 | Saltbr-in | 2.9166 | HRD-in | -68.26, -48.37 | 71.29, -4.5 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9721 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnio | APE10-dihe-na | 999.0, 162.63 | APE9-dihe-na | 97.71, -154.08 | APE8-dihe-in | -75.95, 125.62 | APE8-rot-out | 63.5 | APE67-dihe-in | -42.44, -40.72 | -78.86, -26.19 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-in | 7.9414 | APE9-dist-out | 7.9957 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | C | 399.0 | 387.0 | 2 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7p6q | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QD | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.282 | 13.2775 | BLAminus | -144.35, 168.09 | 60.51, 86.98 | -102.62, 32.26 | 301.67, 102.33 | -72.56, -19.6 | in-in | in | 8.6255 | Saltbr-in | 2.9146 | HRD-in | -67.92, -48.44 | 71.11, -3.01 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9762 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -97.55, 159.64 | APE9-dihe-na | 118.49, 149.2 | APE8-dihe-in | -71.69, 137.89 | APE8-rot-out | 54.73 | APE67-dihe-in | -45.23, -39.33 | -77.36, -30.49 | APE12-dist-in | 12.6103 | APE11-dist-in | 11.4713 | APE10-dist-in | 5.7837 | APE9-dist-in | 5.2067 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | D | 399.0 | 383.0 | 6 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7p6q | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | ROCK2 | ROCK2_HUMAN | 7P6QA | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.3544 | 13.3521 | BLAminus | -144.62, 167.8 | 60.55, 87.07 | -103.28, 32.93 | 301.59, 102.75 | -70.91, -20.49 | in-in | in | 8.6243 | Saltbr-in | 2.7039 | HRD-in | -68.26, -48.48 | 72.01, -4.52 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.994 | 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, 127.2 | APE8-rot-out | 61.47 | APE67-dihe-in | -43.02, -40.39 | -80.11, -25.58 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | A | 399.0 | 377.0 | 13 | 29 | 17 | 12 | [[92, 354]] | 1.0 | 7p6q | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QB | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.3 | 13.3089 | BLAminus | -144.44, 167.29 | 60.61, 86.93 | -103.67, 32.19 | 301.37, 101.58 | -69.29, -21.55 | in-in | in | 8.6066 | Saltbr-in | 2.913 | HRD-in | -66.9, -49.14 | 71.14, -2.98 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9639 | 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, 125.87 | APE8-rot-out | 59.05 | APE67-dihe-in | -44.93, -40.33 | -80.35, -26.21 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | B | 399.0 | 374.0 | 15 | 29 | 17 | 12 | [[92, 354]] | 1.0 | 7p6q | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QC | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.2846 | 13.3478 | BLAminus | -141.89, 172.56 | 57.11, 86.76 | -103.5, 32.32 | 300.6, 102.23 | -70.12, -20.17 | in-in | in | 8.6371 | Saltbr-in | 2.9166 | HRD-in | -68.26, -48.37 | 71.29, -4.5 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9721 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnio | APE10-dihe-na | 999.0, 162.63 | APE9-dihe-na | 97.71, -154.08 | APE8-dihe-in | -75.95, 125.62 | APE8-rot-out | 63.5 | APE67-dihe-in | -42.44, -40.72 | -78.86, -26.19 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-in | 7.9414 | APE9-dist-out | 7.9957 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | C | 399.0 | 387.0 | 2 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7p6q | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 | 7P6QD | O75116 | 24 | 417 | 1388.0 | 5YO:501 | Type1 | Inactive | DFGin | 6.282 | 13.2775 | BLAminus | -144.35, 168.09 | 60.51, 86.98 | -102.62, 32.26 | 301.67, 102.33 | -72.56, -19.6 | in-in | in | 8.6255 | Saltbr-in | 2.9146 | HRD-in | -67.92, -48.44 | 71.11, -3.01 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9762 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -97.55, 159.64 | APE9-dihe-na | 118.49, 149.2 | APE8-dihe-in | -71.69, 137.89 | APE8-rot-out | 54.73 | APE67-dihe-in | -45.23, -39.33 | -77.36, -30.49 | APE12-dist-in | 12.6103 | APE11-dist-in | 11.4713 | APE10-dist-in | 5.7837 | APE9-dist-in | 5.2067 | None | None | None | XRAY | 2.89 | 0.209 | 0.266 | D | 399.0 | 383.0 | 6 | 29 | 27 | 2 | [[92, 354]] | 1.0 | 7p6q | Homo sapiens | AGC_ROCK2_HUMAN | AGC | 2.3e-93 | 318.0 | 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 |
|---|