| 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 | 2YDJA | O14757 | 8 | 269 | 476.0 | YDJ:1270 | Type1 | Active | DFGin | 6.8522 | 14.043 | BLAminus | -131.16, 158.84 | 66.63, 79.17 | -91.38, 22.19 | 287.3, 85.3 | -65.89, -18.2 | in-in | in | 8.5955 | Saltbr-in | 3.0781 | HRD-in | -81.14, -43.61 | 73.59, 1.69 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9625 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.06, 143.33 | APE9-dihe-na | 116.46, -165.7 | APE8-dihe-in | -122.14, 128.4 | APE8-rot-in | 305.87 | APE67-dihe-in | -59.89, -24.88 | -48.54, -44.68 | APE12-dist-in | 8.904 | APE11-dist-in | 11.5313 | APE10-dist-in | 5.9915 | APE9-dist-in | 3.7031 | None | None | CSS57,CSS168 | XRAY | 1.85 | 0.231 | 0.274 | A | 276.0 | 254.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2ydj | CAMK_CHEK1_HUMAN | CAMK | 2.2e-71 | 246.1 | 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 | 2YDJB | O14757 | 9 | 269 | 476.0 | YDJ:1270 | Type1 | Active | DFGin | 6.8557 | 13.9526 | BLAminus | -128.99, 157.39 | 65.68, 84.37 | -94.19, 20.4 | 292.81, 85.67 | -57.98, -21.82 | in-in | in | 8.5766 | Saltbr-in | 2.7274 | HRD-in | -82.83, -45.03 | 78.79, -0.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9252 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.08, 148.59 | APE9-dihe-na | 113.79, -160.81 | APE8-dihe-in | -130.66, 123.13 | APE8-rot-in | 312.19 | APE67-dihe-in | -61.27, -23.44 | -46.66, -47.69 | APE12-dist-in | 8.7612 | APE11-dist-in | 11.5037 | APE10-dist-in | 5.8807 | APE9-dist-in | 3.486 | None | None | CSS57,CSS168 | XRAY | 1.85 | 0.231 | 0.274 | B | 276.0 | 253.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2ydj | CAMK_CHEK1_HUMAN | CAMK | 2.2e-71 | 246.1 | 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 | 2YDJA | O14757 | 8 | 269 | 476.0 | YDJ:1270 | Type1 | Active | DFGin | 6.8522 | 14.043 | BLAminus | -131.16, 158.84 | 66.63, 79.17 | -91.38, 22.19 | 287.3, 85.3 | -65.89, -18.2 | in-in | in | 8.5955 | Saltbr-in | 3.0781 | HRD-in | -81.14, -43.61 | 73.59, 1.69 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9625 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.06, 143.33 | APE9-dihe-na | 116.46, -165.7 | APE8-dihe-in | -122.14, 128.4 | APE8-rot-in | 305.87 | APE67-dihe-in | -59.89, -24.88 | -48.54, -44.68 | APE12-dist-in | 8.904 | APE11-dist-in | 11.5313 | APE10-dist-in | 5.9915 | APE9-dist-in | 3.7031 | None | None | CSS57,CSS168 | XRAY | 1.85 | 0.231 | 0.274 | A | 276.0 | 254.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2ydj | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 2.2e-71 | 246.1 | 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 | 2YDJB | O14757 | 9 | 269 | 476.0 | YDJ:1270 | Type1 | Active | DFGin | 6.8557 | 13.9526 | BLAminus | -128.99, 157.39 | 65.68, 84.37 | -94.19, 20.4 | 292.81, 85.67 | -57.98, -21.82 | in-in | in | 8.5766 | Saltbr-in | 2.7274 | HRD-in | -82.83, -45.03 | 78.79, -0.66 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9252 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.08, 148.59 | APE9-dihe-na | 113.79, -160.81 | APE8-dihe-in | -130.66, 123.13 | APE8-rot-in | 312.19 | APE67-dihe-in | -61.27, -23.44 | -46.66, -47.69 | APE12-dist-in | 8.7612 | APE11-dist-in | 11.5037 | APE10-dist-in | 5.8807 | APE9-dist-in | 3.486 | None | None | CSS57,CSS168 | XRAY | 1.85 | 0.231 | 0.274 | B | 276.0 | 253.0 | 8 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 2ydj | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 2.2e-71 | 246.1 | 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 |
|---|