| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | PAK4 | PAK4_HUMAN | AF-O96013-K1A | O96013 | 313 | 580 | 591.0 | No_ligand | No_ligand | Active | DFGin | 5.9758 | 13.4929 | BLAminus | -130.1, -176.91 | 63.02, 54.98 | -77.11, 5.6 | 302.38, 102.83 | -58.72, -35.23 | in-in | in | 7.715 | Saltbr-in | 2.6955 | HRD-in | -71.08, -49.97 | 65.46, 11.72 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8173 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -144.24, 162.55 | APE9-dihe-na | 107.8, 178.89 | APE8-dihe-in | -83.65, 126.03 | APE8-rot-in | 303.62 | APE67-dihe-in | -75.87, -21.96 | -48.06, -42.55 | APE12-dist-in | 9.0358 | APE11-dist-in | 11.6385 | APE10-dist-in | 5.6736 | APE9-dist-in | 3.2426 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | AF-O96013-K1 | STE_PAK4_HUMAN | STE | 1.3e-88 | 302.6 | 5.0 | 257.0 | 253.0 | 457 | 458 | 459 | 461 | 463 | 350 | 366 | 370 | 437 | 439 | 438 | 440.0 | 497 | 485 | 480 | 479 | 478 | 477 | 476 | 475 | 474 | 396 | Serine/threonine-protein kinase PAK 4 |
| STE | PAK4 | PAK4_HUMAN | AF-O96013-K3A | O96013 | 313 | 580 | 591.0 | No_ligand | No_ligand | Active | DFGin | 6.9815 | 14.9757 | BLAminus | -136.02, -172.75 | 59.27, 53.41 | -76.06, 16.58 | 290.59, 81.49 | -60.1, -26.15 | in-in | in | 8.1793 | Saltbr-in | 2.7904 | HRD-in | -73.8, -46.38 | 65.56, -0.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8534 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.08, 135.85 | APE9-dihe-na | 132.39, 173.54 | APE8-dihe-in | -86.18, 126.08 | APE8-rot-in | 300.1 | APE67-dihe-in | -76.89, -22.75 | -42.41, -45.98 | APE12-dist-in | 9.021 | APE11-dist-in | 11.4862 | APE10-dist-in | 5.6169 | APE9-dist-in | 3.1252 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | AF-O96013-K3 | STE_PAK4_HUMAN | STE | 1.3e-88 | 302.6 | 5.0 | 257.0 | 253.0 | 457 | 458 | 459 | 461 | 463 | 350 | 366 | 370 | 437 | 439 | 438 | 440.0 | 497 | 485 | 480 | 479 | 478 | 477 | 476 | 475 | 474 | 396 | Serine/threonine-protein kinase PAK 4 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | PAK4 | PAK4_HUMAN | AF-O96013-K1A | O96013 | 313 | 580 | 591.0 | No_ligand | No_ligand | Active | DFGin | 5.9758 | 13.4929 | BLAminus | -130.1, -176.91 | 63.02, 54.98 | -77.11, 5.6 | 302.38, 102.83 | -58.72, -35.23 | in-in | in | 7.715 | Saltbr-in | 2.6955 | HRD-in | -71.08, -49.97 | 65.46, 11.72 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8173 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -144.24, 162.55 | APE9-dihe-na | 107.8, 178.89 | APE8-dihe-in | -83.65, 126.03 | APE8-rot-in | 303.62 | APE67-dihe-in | -75.87, -21.96 | -48.06, -42.55 | APE12-dist-in | 9.0358 | APE11-dist-in | 11.6385 | APE10-dist-in | 5.6736 | APE9-dist-in | 3.2426 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | AF-O96013-K1 | Homo sapiens | STE_PAK4_HUMAN | STE | 1.3e-88 | 302.6 | 5.0 | 257.0 | 253.0 | 457 | 458 | 459 | 461 | 463 | 350 | 366 | 370 | 437 | 439 | 438 | 440.0 | 497 | 485 | 480 | 479 | 478 | 477 | 476 | 475 | 474 | 396 | Serine/threonine-protein kinase PAK 4 |
| STE | PAK4 | PAK4_HUMAN | AF-O96013-K3A | O96013 | 313 | 580 | 591.0 | No_ligand | No_ligand | Active | DFGin | 6.9815 | 14.9757 | BLAminus | -136.02, -172.75 | 59.27, 53.41 | -76.06, 16.58 | 290.59, 81.49 | -60.1, -26.15 | in-in | in | 8.1793 | Saltbr-in | 2.7904 | HRD-in | -73.8, -46.38 | 65.56, -0.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8534 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -135.08, 135.85 | APE9-dihe-na | 132.39, 173.54 | APE8-dihe-in | -86.18, 126.08 | APE8-rot-in | 300.1 | APE67-dihe-in | -76.89, -22.75 | -42.41, -45.98 | APE12-dist-in | 9.021 | APE11-dist-in | 11.4862 | APE10-dist-in | 5.6169 | APE9-dist-in | 3.1252 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268.0 | 268.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | AF-O96013-K3 | Homo sapiens | STE_PAK4_HUMAN | STE | 1.3e-88 | 302.6 | 5.0 | 257.0 | 253.0 | 457 | 458 | 459 | 461 | 463 | 350 | 366 | 370 | 437 | 439 | 438 | 440.0 | 497 | 485 | 480 | 479 | 478 | 477 | 476 | 475 | 474 | 396 | Serine/threonine-protein kinase PAK 4 |
| 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 |
|---|