| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CLK1 | CLK1_HUMAN | 5J1VA | P49759 | 148 | 483 | 484.0 | 6FD:60501 | Type1 | Active | DFGin | 7.1 | 14.1716 | BLAminus | -126.87, 172.93 | 72.75, 87.91 | -109.91, 21.95 | 296.61, 87.13 | -77.69, -9.89 | in-in | in | 8.5266 | Saltbr-in | 2.7359 | HRD-in | -74.36, -52.4 | 82.96, -16.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8778 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.9, 168.51 | APE9-dihe-na | 72.23, 149.39 | APE8-dihe-in | -71.93, 136.52 | APE8-rot-in | 285.15 | APE67-dihe-in | -66.67, -20.56 | -35.82, -53.71 | APE12-dist-in | 13.5279 | APE11-dist-in | 11.4445 | APE10-dist-in | 7.2811 | APE9-dist-in | 3.0427 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | A | 339.0 | 336.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5j1v | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5J1VB | P49759 | 148 | 482 | 484.0 | 6FD:60501 | Type1 | Active | DFGin | 7.1093 | 14.1198 | BLAminus | -126.74, 175.0 | 70.24, 87.64 | -108.44, 20.05 | 295.73, 90.04 | -77.7, -8.55 | in-in | in | 8.5763 | Saltbr-in | 2.7543 | HRD-in | -73.08, -51.15 | 80.15, -14.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8769 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.41, 168.72 | APE9-dihe-na | 72.72, 151.05 | APE8-dihe-in | -70.92, 135.35 | APE8-rot-in | 286.36 | APE67-dihe-in | -65.82, -21.41 | -37.05, -51.94 | APE12-dist-in | 13.782 | APE11-dist-in | 11.5423 | APE10-dist-in | 7.3562 | APE9-dist-in | 3.0498 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | B | 339.0 | 335.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5j1v | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5J1VC | P49759 | 148 | 483 | 484.0 | 6FD:60501 | Type1 | Inactive | DFGin | 7.0653 | 14.1863 | BLAminus | -127.76, 172.5 | 71.94, 87.97 | -108.84, 22.87 | 296.53, 88.54 | -79.84, -9.02 | in-in | in | 8.5354 | Saltbr-in | 2.7469 | HRD-in | -76.64, -52.07 | 83.95, -17.44 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8928 | ActLoopCT-out | nonTYR | APEdihe_aannn | APEdist_oion | APE10-dihe-na | -156.89, 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, -20.42 | 999.0, 999.0 | APE12-dist-out | 14.2512 | APE11-dist-in | 11.6023 | APE10-dist-out | 9.6806 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | C | 339.0 | 312.0 | 24 | 25 | 22 | 3 | [[161, 477]] | 1.0 | 5j1v | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CLK1 | CLK1_HUMAN | 5J1VA | P49759 | 148 | 483 | 484.0 | 6FD:60501 | Type1 | Active | DFGin | 7.1 | 14.1716 | BLAminus | -126.87, 172.93 | 72.75, 87.91 | -109.91, 21.95 | 296.61, 87.13 | -77.69, -9.89 | in-in | in | 8.5266 | Saltbr-in | 2.7359 | HRD-in | -74.36, -52.4 | 82.96, -16.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8778 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.9, 168.51 | APE9-dihe-na | 72.23, 149.39 | APE8-dihe-in | -71.93, 136.52 | APE8-rot-in | 285.15 | APE67-dihe-in | -66.67, -20.56 | -35.82, -53.71 | APE12-dist-in | 13.5279 | APE11-dist-in | 11.4445 | APE10-dist-in | 7.2811 | APE9-dist-in | 3.0427 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | A | 339.0 | 336.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5j1v | Homo sapiens | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5J1VB | P49759 | 148 | 482 | 484.0 | 6FD:60501 | Type1 | Active | DFGin | 7.1093 | 14.1198 | BLAminus | -126.74, 175.0 | 70.24, 87.64 | -108.44, 20.05 | 295.73, 90.04 | -77.7, -8.55 | in-in | in | 8.5763 | Saltbr-in | 2.7543 | HRD-in | -73.08, -51.15 | 80.15, -14.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8769 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.41, 168.72 | APE9-dihe-na | 72.72, 151.05 | APE8-dihe-in | -70.92, 135.35 | APE8-rot-in | 286.36 | APE67-dihe-in | -65.82, -21.41 | -37.05, -51.94 | APE12-dist-in | 13.782 | APE11-dist-in | 11.5423 | APE10-dist-in | 7.3562 | APE9-dist-in | 3.0498 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | B | 339.0 | 335.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5j1v | Homo sapiens | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5J1VC | P49759 | 148 | 483 | 484.0 | 6FD:60501 | Type1 | Inactive | DFGin | 7.0653 | 14.1863 | BLAminus | -127.76, 172.5 | 71.94, 87.97 | -108.84, 22.87 | 296.53, 88.54 | -79.84, -9.02 | in-in | in | 8.5354 | Saltbr-in | 2.7469 | HRD-in | -76.64, -52.07 | 83.95, -17.44 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8928 | ActLoopCT-out | nonTYR | APEdihe_aannn | APEdist_oion | APE10-dihe-na | -156.89, 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, -20.42 | 999.0, 999.0 | APE12-dist-out | 14.2512 | APE11-dist-in | 11.6023 | APE10-dist-out | 9.6806 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.52 | 0.201 | 0.244 | C | 339.0 | 312.0 | 24 | 25 | 22 | 3 | [[161, 477]] | 1.0 | 5j1v | Homo sapiens | CMGC_CLK1_HUMAN | CMGC | 2.5e-93 | 318.5 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| 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 |
|---|