| 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 | CDK16 | CDK16_HUMAN | 5G6VA | Q00536 | 163 | 474 | 496.0 | 919:61475 | Type2 | Inactive | DFGout | 14.197 | 9.592 | BBAminus | -121.31, 168.89 | -135.99, 99.11 | -71.7, -18.89 | 281.11, 104.22 | 81.3, -120.31 | in-in | in | 8.6104 | Saltbr-in | 2.6336 | HRD-in | -70.2, -56.21 | 78.25, -5.64 | in-out-out | SNCioo | out-out | ActLoopNT-out | 18.4004 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_iooo | APE10-dihe-na | -97.04, 112.11 | APE9-dihe-na | -121.65, 12.66 | APE8-dihe-out | -41.77, -45.44 | APE8-rot-in | 308.9 | APE67-dihe-in | -49.91, -30.99 | -101.95, -17.17 | APE12-dist-in | 12.5547 | APE11-dist-out | 14.3176 | APE10-dist-out | 12.8314 | APE9-dist-out | 11.3069 | S319D | None | None | XRAY | 2.2 | 0.211 | 0.271 | A | 324.0 | 307.0 | 5 | 28 | 23 | 5 | [[165, 446]] | 1.0 | 5g6v | CMGC_CDK16_HUMAN | CMGC | 1.3e-83 | 286.9 | 1.0 | 301.0 | 301.0 | 303 | 304 | 305 | 307 | 309 | 194 | 211 | 215 | 283 | 285 | 284 | 286.0 | 344 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 241 | Cyclin-dependent kinase 16 |
| CMGC | CDK16 | CDK16_HUMAN | 5G6VB | Q00536 | 163 | 475 | 496.0 | 919:61475 | Type2 | Inactive | DFGout | 14.7022 | 10.3484 | None | -133.8, 175.0 | -147.55, 99.49 | -161.85, 159.42 | 69.16, 120.87 | -118.14, 117.72 | in-in | in | 8.8188 | Saltbr-in | 2.7269 | HRD-in | -62.7, -57.87 | 75.37, 3.15 | in-out-out | SNCioo | out-out | ActLoopNT-out | 23.3281 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -26.32 | APE8-dihe-out | -33.08, -72.64 | APE8-rot-in | 304.04 | APE67-dihe-in | -60.88, -29.71 | -104.87, 15.39 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.511 | S319D | None | None | XRAY | 2.2 | 0.211 | 0.271 | B | 324.0 | 301.0 | 12 | 28 | 16 | 12 | [[165, 446]] | 1.0 | 5g6v | CMGC_CDK16_HUMAN | CMGC | 1.3e-83 | 286.9 | 1.0 | 301.0 | 301.0 | 303 | 304 | 305 | 307 | 309 | 194 | 211 | 215 | 283 | 285 | 284 | 286.0 | 344 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 241 | Cyclin-dependent kinase 16 |
| 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 | CDK16 | CDK16_HUMAN | 5G6VA | Q00536 | 163 | 474 | 496.0 | 919:61475 | Type2 | Inactive | DFGout | 14.197 | 9.592 | BBAminus | -121.31, 168.89 | -135.99, 99.11 | -71.7, -18.89 | 281.11, 104.22 | 81.3, -120.31 | in-in | in | 8.6104 | Saltbr-in | 2.6336 | HRD-in | -70.2, -56.21 | 78.25, -5.64 | in-out-out | SNCioo | out-out | ActLoopNT-out | 18.4004 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_iooo | APE10-dihe-na | -97.04, 112.11 | APE9-dihe-na | -121.65, 12.66 | APE8-dihe-out | -41.77, -45.44 | APE8-rot-in | 308.9 | APE67-dihe-in | -49.91, -30.99 | -101.95, -17.17 | APE12-dist-in | 12.5547 | APE11-dist-out | 14.3176 | APE10-dist-out | 12.8314 | APE9-dist-out | 11.3069 | S319D | None | None | XRAY | 2.2 | 0.211 | 0.271 | A | 324.0 | 307.0 | 5 | 28 | 23 | 5 | [[165, 446]] | 1.0 | 5g6v | Homo sapiens | CMGC_CDK16_HUMAN | CMGC | 1.3e-83 | 286.9 | 1.0 | 301.0 | 301.0 | 303 | 304 | 305 | 307 | 309 | 194 | 211 | 215 | 283 | 285 | 284 | 286.0 | 344 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 241 | Cyclin-dependent kinase 16 |
| CMGC | CDK16 | CDK16_HUMAN | 5G6VB | Q00536 | 163 | 475 | 496.0 | 919:61475 | Type2 | Inactive | DFGout | 14.7022 | 10.3484 | None | -133.8, 175.0 | -147.55, 99.49 | -161.85, 159.42 | 69.16, 120.87 | -118.14, 117.72 | in-in | in | 8.8188 | Saltbr-in | 2.7269 | HRD-in | -62.7, -57.87 | 75.37, 3.15 | in-out-out | SNCioo | out-out | ActLoopNT-out | 23.3281 | ActLoopCT-out | nonTYR | APEdihe_aaoii | APEdist_nnno | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, -26.32 | APE8-dihe-out | -33.08, -72.64 | APE8-rot-in | 304.04 | APE67-dihe-in | -60.88, -29.71 | -104.87, 15.39 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-out | 11.511 | S319D | None | None | XRAY | 2.2 | 0.211 | 0.271 | B | 324.0 | 301.0 | 12 | 28 | 16 | 12 | [[165, 446]] | 1.0 | 5g6v | Homo sapiens | CMGC_CDK16_HUMAN | CMGC | 1.3e-83 | 286.9 | 1.0 | 301.0 | 301.0 | 303 | 304 | 305 | 307 | 309 | 194 | 211 | 215 | 283 | 285 | 284 | 286.0 | 344 | 331 | 326 | 325 | 324 | 323 | 322 | 321 | 320 | 241 | Cyclin-dependent kinase 16 |
| 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 |
|---|