| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | PRKCA | KPCA_HUMAN | 3IW4A | P17252 | 331 | 669 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.6235 | 13.8179 | BLAminus | -108.9, -177.56 | 59.08, 89.37 | -106.96, 24.06 | 294.83, 102.31 | -75.53, 23.85 | in-in | in | 8.8151 | Saltbr-in | 2.4103 | HRD-in | -74.65, -45.15 | 57.81, 14.63 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8188 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -177.54, 165.03 | APE9-dihe-na | 118.37, 165.26 | APE8-dihe-in | -73.23, 122.76 | APE8-rot-in | 296.87 | APE67-dihe-in | -65.34, -19.42 | -43.95, -40.88 | APE12-dist-in | 9.5971 | APE11-dist-in | 12.4038 | APE10-dist-in | 7.1979 | APE9-dist-in | 4.2777 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | A | 360.0 | 332.0 | 0 | 28 | 28 | 0 | [[339, 597]] | 1.0 | 3iw4 | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| AGC | PRKCA | KPCA_HUMAN | 3IW4B | P17252 | 332 | 666 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.4178 | 13.3048 | BLAminus | -121.94, -178.66 | 60.88, 102.14 | -120.38, 26.83 | 301.99, 84.51 | -64.84, -10.1 | in-in | in | 8.502 | Saltbr-in | 2.2773 | HRD-in | -77.23, -55.63 | 71.28, 15.73 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8954 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -176.82, 155.18 | APE9-dihe-na | 134.69, -179.0 | APE8-dihe-in | -84.78, 118.85 | APE8-rot-in | 310.63 | APE67-dihe-in | -51.46, -22.6 | -31.15, -62.66 | APE12-dist-in | 9.6701 | APE11-dist-in | 12.1792 | APE10-dist-in | 6.9549 | APE9-dist-in | 3.9065 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | B | 360.0 | 327.0 | 1 | 28 | 27 | 1 | [[339, 597]] | 1.0 | 3iw4 | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| AGC | PRKCA | KPCA_HUMAN | 3IW4C | P17252 | 330 | 670 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.4624 | 13.4219 | BLAminus | -141.95, -178.5 | 58.36, 93.1 | -108.43, 30.26 | 303.23, 90.16 | -75.14, 20.66 | in-in | in | 8.6885 | Saltbr-in | 2.5685 | HRD-in | -74.14, -54.37 | 68.8, 7.36 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9529 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -167.97, 175.07 | APE9-dihe-na | 106.85, 167.92 | APE8-dihe-in | -78.66, 121.4 | APE8-rot-in | 308.52 | APE67-dihe-in | -55.88, -21.85 | -44.2, -44.83 | APE12-dist-in | 9.9776 | APE11-dist-in | 12.2087 | APE10-dist-in | 6.9176 | APE9-dist-in | 4.2752 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | C | 360.0 | 334.0 | 0 | 28 | 28 | 0 | [[339, 597]] | 1.0 | 3iw4 | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | PRKCA | KPCA_HUMAN | 3IW4A | P17252 | 331 | 669 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.6235 | 13.8179 | BLAminus | -108.9, -177.56 | 59.08, 89.37 | -106.96, 24.06 | 294.83, 102.31 | -75.53, 23.85 | in-in | in | 8.8151 | Saltbr-in | 2.4103 | HRD-in | -74.65, -45.15 | 57.81, 14.63 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8188 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -177.54, 165.03 | APE9-dihe-na | 118.37, 165.26 | APE8-dihe-in | -73.23, 122.76 | APE8-rot-in | 296.87 | APE67-dihe-in | -65.34, -19.42 | -43.95, -40.88 | APE12-dist-in | 9.5971 | APE11-dist-in | 12.4038 | APE10-dist-in | 7.1979 | APE9-dist-in | 4.2777 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | A | 360.0 | 332.0 | 0 | 28 | 28 | 0 | [[339, 597]] | 1.0 | 3iw4 | Homo sapiens | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| AGC | PRKCA | KPCA_HUMAN | 3IW4B | P17252 | 332 | 666 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.4178 | 13.3048 | BLAminus | -121.94, -178.66 | 60.88, 102.14 | -120.38, 26.83 | 301.99, 84.51 | -64.84, -10.1 | in-in | in | 8.502 | Saltbr-in | 2.2773 | HRD-in | -77.23, -55.63 | 71.28, 15.73 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8954 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -176.82, 155.18 | APE9-dihe-na | 134.69, -179.0 | APE8-dihe-in | -84.78, 118.85 | APE8-rot-in | 310.63 | APE67-dihe-in | -51.46, -22.6 | -31.15, -62.66 | APE12-dist-in | 9.6701 | APE11-dist-in | 12.1792 | APE10-dist-in | 6.9549 | APE9-dist-in | 3.9065 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | B | 360.0 | 327.0 | 1 | 28 | 27 | 1 | [[339, 597]] | 1.0 | 3iw4 | Homo sapiens | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| AGC | PRKCA | KPCA_HUMAN | 3IW4C | P17252 | 330 | 670 | 672.0 | LW4:901 | Type1 | Active | DFGin | 6.4624 | 13.4219 | BLAminus | -141.95, -178.5 | 58.36, 93.1 | -108.43, 30.26 | 303.23, 90.16 | -75.14, 20.66 | in-in | in | 8.6885 | Saltbr-in | 2.5685 | HRD-in | -74.14, -54.37 | 68.8, 7.36 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9529 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -167.97, 175.07 | APE9-dihe-na | 106.85, 167.92 | APE8-dihe-in | -78.66, 121.4 | APE8-rot-in | 308.52 | APE67-dihe-in | -55.88, -21.85 | -44.2, -44.83 | APE12-dist-in | 9.9776 | APE11-dist-in | 12.2087 | APE10-dist-in | 6.9176 | APE9-dist-in | 4.2752 | T497E | TPO638,SEP657 | TPO638,SEP657 | XRAY | 2.8 | 0.196 | 0.277 | C | 360.0 | 334.0 | 0 | 28 | 28 | 0 | [[339, 597]] | 1.0 | 3iw4 | Homo sapiens | AGC_PRKCA_HUMAN | AGC | 6.5e-99 | 336.2 | 1.0 | 260.0 | 260.0 | 480 | 481 | 482 | 484 | 486 | 368 | 387 | 391 | 460 | 462 | 461 | 463.0 | 520 | 508 | 503 | 502 | 501 | 500 | 499 | 498 | 497 | 418 | Protein kinase C alpha type |
| 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 |
|---|