| 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 | 4FIEA | O96013 | 49 | 590 | 591.0 | ANP:1001 | ATPlike | Inactive | DFGin | 6.2776 | 14.0298 | BLAminus | -142.71, -177.86 | 63.75, 67.7 | -92.97, 13.53 | 295.29, 98.36 | -64.15, -7.0 | in-out | in | 6.9911 | Saltbr-out | 3.9737 | HRD-in | -74.78, -36.69 | 67.65, -13.13 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8563 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.98, 139.97 | APE9-dihe-na | 123.6, -177.34 | APE8-dihe-in | -84.44, 139.76 | APE8-rot-out | 19.51 | APE67-dihe-in | -74.38, -37.99 | -51.24, -48.18 | APE12-dist-in | 9.5152 | APE11-dist-in | 11.685 | APE10-dist-in | 5.9086 | APE9-dist-in | 3.5078 | None | SEP474 | SEP474 | XRAY | 3.11 | 0.257 | 0.276 | A | 423.0 | 301.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | 4fie | STE_PAK4_HUMAN | STE | 5.6e-88 | 300.6 | 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 | 4FIEB | O96013 | 49 | 590 | 591.0 | ANP:1001 | ATPlike | Inactive | DFGin | 6.2778 | 14.0307 | BLAminus | -142.24, -177.62 | 63.59, 67.55 | -92.7, 13.49 | 295.33, 98.22 | -64.04, -7.21 | in-out | in | 6.9889 | Saltbr-out | 3.957 | HRD-in | -74.95, -36.21 | 66.97, -12.74 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8574 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -136.0, 139.86 | APE9-dihe-na | 123.6, -177.41 | APE8-dihe-in | -84.57, 139.76 | APE8-rot-out | 19.62 | APE67-dihe-in | -74.42, -37.89 | -51.19, -48.15 | APE12-dist-in | 9.5148 | APE11-dist-in | 11.6892 | APE10-dist-in | 5.912 | APE9-dist-in | 3.5096 | None | SEP474 | SEP474 | XRAY | 3.11 | 0.257 | 0.276 | B | 423.0 | 301.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | 4fie | STE_PAK4_HUMAN | STE | 5.6e-88 | 300.6 | 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 | 4FIEA | O96013 | 49 | 590 | 591.0 | ANP:1001 | ATPlike | Inactive | DFGin | 6.2776 | 14.0298 | BLAminus | -142.71, -177.86 | 63.75, 67.7 | -92.97, 13.53 | 295.29, 98.36 | -64.15, -7.0 | in-out | in | 6.9911 | Saltbr-out | 3.9737 | HRD-in | -74.78, -36.69 | 67.65, -13.13 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8563 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -135.98, 139.97 | APE9-dihe-na | 123.6, -177.34 | APE8-dihe-in | -84.44, 139.76 | APE8-rot-out | 19.51 | APE67-dihe-in | -74.38, -37.99 | -51.24, -48.18 | APE12-dist-in | 9.5152 | APE11-dist-in | 11.685 | APE10-dist-in | 5.9086 | APE9-dist-in | 3.5078 | None | SEP474 | SEP474 | XRAY | 3.11 | 0.257 | 0.276 | A | 423.0 | 301.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | 4fie | Homo sapiens | STE_PAK4_HUMAN | STE | 5.6e-88 | 300.6 | 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 | 4FIEB | O96013 | 49 | 590 | 591.0 | ANP:1001 | ATPlike | Inactive | DFGin | 6.2778 | 14.0307 | BLAminus | -142.24, -177.62 | 63.59, 67.55 | -92.7, 13.49 | 295.33, 98.22 | -64.04, -7.21 | in-out | in | 6.9889 | Saltbr-out | 3.957 | HRD-in | -74.95, -36.21 | 66.97, -12.74 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8574 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -136.0, 139.86 | APE9-dihe-na | 123.6, -177.41 | APE8-dihe-in | -84.57, 139.76 | APE8-rot-out | 19.62 | APE67-dihe-in | -74.42, -37.89 | -51.19, -48.15 | APE12-dist-in | 9.5148 | APE11-dist-in | 11.6892 | APE10-dist-in | 5.912 | APE9-dist-in | 3.5096 | None | SEP474 | SEP474 | XRAY | 3.11 | 0.257 | 0.276 | B | 423.0 | 301.0 | 0 | 28 | 28 | 0 | [[321, 572]] | 1.0 | 4fie | Homo sapiens | STE_PAK4_HUMAN | STE | 5.6e-88 | 300.6 | 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 |
|---|