| 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 | 5OQ7A | O14757 | 8 | 271 | 476.0 | A0Q:301 | Type1 | Active | DFGin | 7.1227 | 14.2842 | BLAminus | -115.9, 149.42 | 83.67, 113.44 | -120.56, 20.12 | 282.1, 87.3 | -60.35, -30.28 | in-in | in | 9.1287 | Saltbr-in | 2.1853 | HRD-in | -72.95, -46.31 | 71.63, 7.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9542 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.79, 177.88 | APE9-dihe-na | 107.24, -147.89 | APE8-dihe-in | -133.83, 123.88 | APE8-rot-in | 304.96 | APE67-dihe-in | -60.86, -17.32 | -51.61, -47.12 | APE12-dist-in | 9.9684 | APE11-dist-in | 11.6303 | APE10-dist-in | 6.087 | APE9-dist-in | 3.7123 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A | None | None | XRAY | 2.1 | 0.259 | 0.324 | A | 297.0 | 259.0 | 5 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5oq7 | CAMK_CHEK1_HUMAN | CAMK | 1e-70 | 243.9 | 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 | 5OQ7B | O14757 | 8 | 270 | 476.0 | A0Q:301 | Type1 | Active | DFGin | 7.0068 | 13.6681 | BLAminus | -123.41, 144.51 | 76.15, 112.19 | -116.09, 30.53 | 288.02, 74.92 | -74.13, -26.43 | in-in | in | 8.5615 | Saltbr-in | 3.4118 | HRD-in | -68.73, -47.06 | 88.33, -2.49 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9632 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.0, 169.92 | APE9-dihe-na | 126.71, -154.19 | APE8-dihe-in | -137.81, 141.49 | APE8-rot-in | 282.73 | APE67-dihe-in | -51.67, -38.82 | -61.07, -53.98 | APE12-dist-in | 9.0252 | APE11-dist-in | 11.5124 | APE10-dist-in | 6.1156 | APE9-dist-in | 3.6989 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A | None | None | XRAY | 2.1 | 0.259 | 0.324 | B | 297.0 | 256.0 | 7 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5oq7 | CAMK_CHEK1_HUMAN | CAMK | 1e-70 | 243.9 | 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 | 5OQ7A | O14757 | 8 | 271 | 476.0 | A0Q:301 | Type1 | Active | DFGin | 7.1227 | 14.2842 | BLAminus | -115.9, 149.42 | 83.67, 113.44 | -120.56, 20.12 | 282.1, 87.3 | -60.35, -30.28 | in-in | in | 9.1287 | Saltbr-in | 2.1853 | HRD-in | -72.95, -46.31 | 71.63, 7.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9542 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -158.79, 177.88 | APE9-dihe-na | 107.24, -147.89 | APE8-dihe-in | -133.83, 123.88 | APE8-rot-in | 304.96 | APE67-dihe-in | -60.86, -17.32 | -51.61, -47.12 | APE12-dist-in | 9.9684 | APE11-dist-in | 11.6303 | APE10-dist-in | 6.087 | APE9-dist-in | 3.7123 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A | None | None | XRAY | 2.1 | 0.259 | 0.324 | A | 297.0 | 259.0 | 5 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5oq7 | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 1e-70 | 243.9 | 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 | 5OQ7B | O14757 | 8 | 270 | 476.0 | A0Q:301 | Type1 | Active | DFGin | 7.0068 | 13.6681 | BLAminus | -123.41, 144.51 | 76.15, 112.19 | -116.09, 30.53 | 288.02, 74.92 | -74.13, -26.43 | in-in | in | 8.5615 | Saltbr-in | 3.4118 | HRD-in | -68.73, -47.06 | 88.33, -2.49 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9632 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -156.0, 169.92 | APE9-dihe-na | 126.71, -154.19 | APE8-dihe-in | -137.81, 141.49 | APE8-rot-in | 282.73 | APE67-dihe-in | -51.67, -38.82 | -61.07, -53.98 | APE12-dist-in | 9.0252 | APE11-dist-in | 11.5124 | APE10-dist-in | 6.1156 | APE9-dist-in | 3.6989 | N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A | None | None | XRAY | 2.1 | 0.259 | 0.324 | B | 297.0 | 256.0 | 7 | 30 | 30 | 0 | [[9, 265]] | 1.0 | 5oq7 | Homo sapiens | CAMK_CHEK1_HUMAN | CAMK | 1e-70 | 243.9 | 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 |
|---|