| PDB | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AF-Q9P286-K1A | 441 | 708 | 719.0 | No_ligand | No_ligand | Active | DFGin | 6.004 | 13.442 | BLAminus | -129.77, -175.07 | 63.13, 52.05 | -75.54, 6.19 | 303.07, 103.68 | -59.01, -34.74 | in-in | in | 7.609 | Saltbr-in | 2.712 | HRD-in | -70.11, -50.47 | 65.78, 8.67 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.792 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.89, 166.12 | APE9-dihe-na | 109.42, 172.62 | APE8-dihe-in | -76.54, 132.8 | APE8-rot-in | 304.61 | APE67-dihe-inflip | 74.32, -45.03 | -49.87, 165.88 | APE12-dist-in | 9.082 | APE11-dist-in | 11.594 | APE10-dist-in | 5.636 | APE9-dist-in | 3.251 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268 | 268 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | AF-Q9P286-K1 | STE_PAK5_HUMAN | STE | 4.3e-89 | 304.2 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| AF-Q9P286-K3A | 441 | 708 | 719.0 | No_ligand | No_ligand | Active | DFGin | 6.262 | 14.249 | BLAminus | -136.89, -172.09 | 63.87, 42.97 | -70.3, 3.31 | 293.18, 91.89 | -56.06, -30.69 | in-in | in | 6.935 | Saltbr-in | 2.706 | HRD-in | -72.56, -46.79 | 67.56, 1.69 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.821 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -145.81, 146.53 | APE9-dihe-na | 121.18, 175.76 | APE8-dihe-in | -89.03, 128.84 | APE8-rot-in | 301.05 | APE67-dihe-in | -75.65, -20.5 | -45.44, -43.26 | APE12-dist-in | 9.012 | APE11-dist-in | 11.454 | APE10-dist-in | 5.729 | APE9-dist-in | 3.049 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268 | 268 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | AF-Q9P286-K3 | STE_PAK5_HUMAN | STE | 4.3e-89 | 304.2 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| 8C12AAA | 426 | 717 | 719.0 | No_ligand | No_ligand | Active | DFGin | 7.443 | 14.738 | BLAminus | -130.39, -175.88 | 62.56, 62.57 | -89.05, 13.56 | 281.14, 76.23 | -54.69, -32.83 | in-in | in | 8.768 | Saltbr-in | 2.706 | HRD-in | -73.87, -52.79 | 77.78, 6.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.868 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.99, 155.01 | APE9-dihe-na | 126.14, -158.85 | APE8-dihe-in | -125.7, 122.59 | APE8-rot-in | 306.85 | APE67-dihe-in | -69.44, -21.48 | -34.95, -54.42 | APE12-dist-in | 8.443 | APE11-dist-in | 10.982 | APE10-dist-in | 5.202 | APE9-dist-in | 3.312 | None | SEP602 | SEP602 | XRAY | 1.549 | 0.199 | 0.234 | AAA | 295 | 292 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 8c12 | STE_PAK5_HUMAN | STE | 6.1e-89 | 303.7 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| 2F57B | 425 | 718 | 719.0 | 23D:60001 | Type1 | Active | DFGin | 7.147 | 15.159 | BLAminus | -130.03, -174.06 | 58.73, 69.39 | -94.87, 19.1 | 283.86, 78.72 | -55.48, -32.98 | in-in | in | 8.325 | Saltbr-in | 2.739 | HRD-in | -71.01, -50.04 | 72.02, 1.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.866 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -139.95, 140.47 | APE9-dihe-na | 141.83, -168.91 | APE8-dihe-in | -111.96, 119.79 | APE8-rot-in | 303.61 | APE67-dihe-in | -66.26, -20.96 | -34.19, -58.65 | APE12-dist-in | 8.913 | APE11-dist-in | 11.471 | APE10-dist-in | 5.682 | APE9-dist-in | 3.406 | None | SEP602 | SEP602 | XRAY | 1.8 | 0.155 | 0.185 | B | 317 | 294 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 2f57 | STE_PAK5_HUMAN | STE | 7.8e-89 | 303.4 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| 2F57A | 425 | 715 | 719.0 | No_ligand | No_ligand | Inactive | DFGin | 7.516 | 15.961 | BLAminus | -132.24, -179.07 | 54.47, 81.52 | -94.01, 25.23 | 285.2, 72.28 | -59.96, -25.16 | out-none | out | 11.079 | Saltbr-none | 999.0 | HRD-in | -72.74, -45.03 | 70.4, -1.95 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.774 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.46, 142.22 | APE9-dihe-na | 144.01, -171.13 | APE8-dihe-in | -106.28, 111.65 | APE8-rot-in | 305.86 | APE67-dihe-in | -64.34, -20.12 | -23.16, -62.0 | APE12-dist-in | 9.075 | APE11-dist-in | 11.453 | APE10-dist-in | 5.611 | APE9-dist-in | 3.752 | None | SEP602 | SEP602 | XRAY | 1.8 | 0.155 | 0.185 | A | 317 | 291 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 2f57 | STE_PAK5_HUMAN | STE | 7.8e-89 | 303.4 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| PAK5_HUMAN | AF-Q9P286-K1A | Q9P286 | 441 | 708 | 719.0 | No_ligand | No_ligand | Active | DFGin | 6.004 | 13.442 | BLAminus | -129.77, -175.07 | 63.13, 52.05 | -75.54, 6.19 | 303.07, 103.68 | -59.01, -34.74 | in-in | in | 7.609 | Saltbr-in | 2.712 | HRD-in | -70.11, -50.47 | 65.78, 8.67 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.792 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.89, 166.12 | APE9-dihe-na | 109.42, 172.62 | APE8-dihe-in | -76.54, 132.8 | APE8-rot-in | 304.61 | APE67-dihe-inflip | 74.32, -45.03 | -49.87, 165.88 | APE12-dist-in | 9.082 | APE11-dist-in | 11.594 | APE10-dist-in | 5.636 | APE9-dist-in | 3.251 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268 | 268 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | AF-Q9P286-K1 | Homo sapiens | STE_PAK5_HUMAN | STE | 4.3e-89 | 304.2 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| PAK5_HUMAN | AF-Q9P286-K3A | Q9P286 | 441 | 708 | 719.0 | No_ligand | No_ligand | Active | DFGin | 6.262 | 14.249 | BLAminus | -136.89, -172.09 | 63.87, 42.97 | -70.3, 3.31 | 293.18, 91.89 | -56.06, -30.69 | in-in | in | 6.935 | Saltbr-in | 2.706 | HRD-in | -72.56, -46.79 | 67.56, 1.69 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.821 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -145.81, 146.53 | APE9-dihe-na | 121.18, 175.76 | APE8-dihe-in | -89.03, 128.84 | APE8-rot-in | 301.05 | APE67-dihe-in | -75.65, -20.5 | -45.44, -43.26 | APE12-dist-in | 9.012 | APE11-dist-in | 11.454 | APE10-dist-in | 5.729 | APE9-dist-in | 3.049 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 268 | 268 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | AF-Q9P286-K3 | Homo sapiens | STE_PAK5_HUMAN | STE | 4.3e-89 | 304.2 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| PAK5_HUMAN | 8C12AAA | Q9P286 | 426 | 717 | 719.0 | No_ligand | No_ligand | Active | DFGin | 7.443 | 14.738 | BLAminus | -130.39, -175.88 | 62.56, 62.57 | -89.05, 13.56 | 281.14, 76.23 | -54.69, -32.83 | in-in | in | 8.768 | Saltbr-in | 2.706 | HRD-in | -73.87, -52.79 | 77.78, 6.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.868 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -143.99, 155.01 | APE9-dihe-na | 126.14, -158.85 | APE8-dihe-in | -125.7, 122.59 | APE8-rot-in | 306.85 | APE67-dihe-in | -69.44, -21.48 | -34.95, -54.42 | APE12-dist-in | 8.443 | APE11-dist-in | 10.982 | APE10-dist-in | 5.202 | APE9-dist-in | 3.312 | None | SEP602 | SEP602 | XRAY | 1.549 | 0.199 | 0.234 | AAA | 295 | 292 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 8c12 | Homo sapiens | STE_PAK5_HUMAN | STE | 6.1e-89 | 303.7 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| PAK5_HUMAN | 2F57B | Q9P286 | 425 | 718 | 719.0 | 23D:60001 | Type1 | Active | DFGin | 7.147 | 15.159 | BLAminus | -130.03, -174.06 | 58.73, 69.39 | -94.87, 19.1 | 283.86, 78.72 | -55.48, -32.98 | in-in | in | 8.325 | Saltbr-in | 2.739 | HRD-in | -71.01, -50.04 | 72.02, 1.25 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.866 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -139.95, 140.47 | APE9-dihe-na | 141.83, -168.91 | APE8-dihe-in | -111.96, 119.79 | APE8-rot-in | 303.61 | APE67-dihe-in | -66.26, -20.96 | -34.19, -58.65 | APE12-dist-in | 8.913 | APE11-dist-in | 11.471 | APE10-dist-in | 5.682 | APE9-dist-in | 3.406 | None | SEP602 | SEP602 | XRAY | 1.8 | 0.155 | 0.185 | B | 317 | 294 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 2f57 | Homo sapiens | STE_PAK5_HUMAN | STE | 7.8e-89 | 303.4 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| PAK5_HUMAN | 2F57A | Q9P286 | 425 | 715 | 719.0 | No_ligand | No_ligand | Inactive | DFGin | 7.516 | 15.961 | BLAminus | -132.24, -179.07 | 54.47, 81.52 | -94.01, 25.23 | 285.2, 72.28 | -59.96, -25.16 | out-none | out | 11.079 | Saltbr-none | 999.0 | HRD-in | -72.74, -45.03 | 70.4, -1.95 | none-in-in | SNCnii | in-in | ActLoopNT-in | 2.774 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.46, 142.22 | APE9-dihe-na | 144.01, -171.13 | APE8-dihe-in | -106.28, 111.65 | APE8-rot-in | 305.86 | APE67-dihe-in | -64.34, -20.12 | -23.16, -62.0 | APE12-dist-in | 9.075 | APE11-dist-in | 11.453 | APE10-dist-in | 5.611 | APE9-dist-in | 3.752 | None | SEP602 | SEP602 | XRAY | 1.8 | 0.155 | 0.185 | A | 317 | 291 | 0 | 0 | 0 | 0 | [[449, 700]] | 1.0 | 2f57 | Homo sapiens | STE_PAK5_HUMAN | STE | 7.8e-89 | 303.4 | 5 | 257 | 253 | 585 | 586 | 587 | 589 | 591 | 478 | 494 | 498 | 565 | 567 | 566 | 568 | 625 | 613 | 608 | 607 | 606 | 605 | 604 | 603 | 602 | 524 | Serine/threonine-protein kinase PAK 5 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| 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 |
|---|