| 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 | CHEK1 | CHK1_HUMAN | 2E9VA | O14757 | 2 | 269 | 476.0 | 85A:1001 | Type1 | Active | DFGin | 6.9752 | 14.6373 | BLAminus | -131.54, 177.83 | 55.26, 98.09 | -109.61, 30.41 | 286.66, 68.67 | -62.59, -29.32 | in-in | in | 8.7015 | Saltbr-in | 2.67 | HRD-in | -76.45, -37.92 | 59.71, 14.92 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8893 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.78, 168.23 | APE9-dihe-na | 122.1, -169.86 | APE8-dihe-in | -111.29, 110.84 | APE8-rot-in | 305.57 | APE67-dihe-in | -47.02, -35.65 | -25.69, -68.51 | APE12-dist-in | 9.4345 | APE11-dist-in | 11.9084 | APE10-dist-in | 6.1426 | APE9-dist-in | 3.5952 | None | None | None | XRAY | 2.0 | 0.279 | 0.333 | A | 268.0 | 268.0 | 0 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2e9v | CAMK_CHEK1_HUMAN | CAMK | 2e-71 | 246.3 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| CAMK | CHEK1 | CHK1_HUMAN | 2E9VB | O14757 | 2 | 269 | 476.0 | 85A:2001 | Type1 | Active | DFGin | 6.9181 | 14.1888 | BLAminus | -126.14, 170.02 | 63.09, 96.2 | -109.54, 31.48 | 299.02, 75.08 | -66.55, -19.9 | in-in | in | 8.2593 | Saltbr-in | 2.6942 | HRD-in | -68.57, -49.41 | 72.45, 8.8 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0956 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.77, 165.61 | APE9-dihe-na | 116.5, -156.5 | APE8-dihe-in | -122.27, 105.18 | APE8-rot-in | 303.15 | APE67-dihe-in | -59.07, -28.34 | -21.14, -51.59 | APE12-dist-in | 9.0333 | APE11-dist-in | 11.8591 | APE10-dist-in | 6.1527 | APE9-dist-in | 3.4622 | None | None | None | XRAY | 2.0 | 0.279 | 0.333 | B | 268.0 | 268.0 | 0 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2e9v | CAMK_CHEK1_HUMAN | CAMK | 2e-71 | 246.3 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| 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 | CHEK1 | CHK1_HUMAN | 2E9VA | O14757 | 2 | 269 | 476.0 | 85A:1001 | Type1 | Active | DFGin | 6.9752 | 14.6373 | BLAminus | -131.54, 177.83 | 55.26, 98.09 | -109.61, 30.41 | 286.66, 68.67 | -62.59, -29.32 | in-in | in | 8.7015 | Saltbr-in | 2.67 | HRD-in | -76.45, -37.92 | 59.71, 14.92 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8893 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.78, 168.23 | APE9-dihe-na | 122.1, -169.86 | APE8-dihe-in | -111.29, 110.84 | APE8-rot-in | 305.57 | APE67-dihe-in | -47.02, -35.65 | -25.69, -68.51 | APE12-dist-in | 9.4345 | APE11-dist-in | 11.9084 | APE10-dist-in | 6.1426 | APE9-dist-in | 3.5952 | None | None | None | XRAY | 2.0 | 0.279 | 0.333 | A | 268.0 | 268.0 | 0 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2e9v | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 2e-71 | 246.3 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| CAMK | CHEK1 | CHK1_HUMAN | 2E9VB | O14757 | 2 | 269 | 476.0 | 85A:2001 | Type1 | Active | DFGin | 6.9181 | 14.1888 | BLAminus | -126.14, 170.02 | 63.09, 96.2 | -109.54, 31.48 | 299.02, 75.08 | -66.55, -19.9 | in-in | in | 8.2593 | Saltbr-in | 2.6942 | HRD-in | -68.57, -49.41 | 72.45, 8.8 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0956 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.77, 165.61 | APE9-dihe-na | 116.5, -156.5 | APE8-dihe-in | -122.27, 105.18 | APE8-rot-in | 303.15 | APE67-dihe-in | -59.07, -28.34 | -21.14, -51.59 | APE12-dist-in | 9.0333 | APE11-dist-in | 11.8591 | APE10-dist-in | 6.1527 | APE9-dist-in | 3.4622 | None | None | None | XRAY | 2.0 | 0.279 | 0.333 | B | 268.0 | 268.0 | 0 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2e9v | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 2e-71 | 246.3 | 2.0 | 256.0 | 255.0 | 147 | 148 | 149 | 151 | 153 | 38 | 55 | 59 | 127 | 129 | 128 | 130.0 | 190 | 177 | 172 | 171 | 170 | 169 | 168 | 167 | 166 | 85 | Serine/threonine-protein kinase Chk1 |
| 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 |
|---|