| 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 | PAK2 | PAK2_HUMAN | 9LBFA | Q13177 | 86 | 522 | 524.0 | No_ligand | No_ligand | Inactive | DFGin | 7.8448 | 13.6141 | BLAplus | -139.51, 166.88 | 74.2, 35.56 | -96.67, -31.69 | 40.66, 100.7 | -123.09, -146.04 | out-out | out | 11.1426 | Saltbr-out | 7.8631 | HRD-in | -64.29, -56.59 | 86.77, -3.8 | out-out-out | SNCooo | out-out | ActLoopNT-out | 11.6767 | ActLoopCT-out | nonTYR | APEdihe_aaiio | APEdist_nnoo | APE10-dihe-na | 999.0, -26.57 | APE9-dihe-na | 176.19, -152.47 | APE8-dihe-in | -84.91, 126.9 | APE8-rot-in | 306.43 | APE67-dihe-out | -58.07, -24.38 | -83.02, 68.66 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 18.6347 | APE9-dist-out | 13.9739 | D368N | None | None | XRAY | 2.62 | 0.199 | 0.222 | A | 479.0 | 351.0 | 8 | 28 | 20 | 8 | [[249, 500]] | 1.0 | 9lbf | STE_PAK2_HUMAN | STE | 4.2e-92 | 314.4 | 1.0 | 257.0 | 257.0 | 385 | 386 | 387 | 389 | 391 | 278 | 294 | 298 | 365 | 367 | 366 | 368.0 | 425 | 413 | 408 | 407 | 406 | 405 | 404 | 403 | 402 | 324 | Serine/threonine-protein kinase PAK 2 |
| STE | PAK2 | PAK2_HUMAN | 9LBFB | Q13177 | 93 | 522 | 524.0 | No_ligand | No_ligand | Inactive | DFGin | 7.0308 | 16.6912 | BLBplus | -134.23, -173.46 | 72.48, 42.23 | -141.91, 145.41 | 70.0, 102.23 | 66.59, -144.55 | out-out | out | 11.2269 | Saltbr-out | 9.4629 | HRD-in | -79.1, -48.8 | 75.21, -20.52 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.1265 | ActLoopCT-out | nonTYR | APEdihe_aanio | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 122.12 | APE8-rot-in | 303.98 | APE67-dihe-out | -61.34, -24.51 | -89.78, 56.48 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | D368N | None | None | XRAY | 2.62 | 0.199 | 0.222 | B | 479.0 | 324.0 | 14 | 28 | 14 | 14 | [[249, 500]] | 1.0 | 9lbf | STE_PAK2_HUMAN | STE | 4.2e-92 | 314.4 | 1.0 | 257.0 | 257.0 | 385 | 386 | 387 | 389 | 391 | 278 | 294 | 298 | 365 | 367 | 366 | 368.0 | 425 | 413 | 408 | 407 | 406 | 405 | 404 | 403 | 402 | 324 | Serine/threonine-protein kinase PAK 2 |
| 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 | PAK2 | PAK2_HUMAN | 9LBFA | Q13177 | 86 | 522 | 524.0 | No_ligand | No_ligand | Inactive | DFGin | 7.8448 | 13.6141 | BLAplus | -139.51, 166.88 | 74.2, 35.56 | -96.67, -31.69 | 40.66, 100.7 | -123.09, -146.04 | out-out | out | 11.1426 | Saltbr-out | 7.8631 | HRD-in | -64.29, -56.59 | 86.77, -3.8 | out-out-out | SNCooo | out-out | ActLoopNT-out | 11.6767 | ActLoopCT-out | nonTYR | APEdihe_aaiio | APEdist_nnoo | APE10-dihe-na | 999.0, -26.57 | APE9-dihe-na | 176.19, -152.47 | APE8-dihe-in | -84.91, 126.9 | APE8-rot-in | 306.43 | APE67-dihe-out | -58.07, -24.38 | -83.02, 68.66 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 18.6347 | APE9-dist-out | 13.9739 | D368N | None | None | XRAY | 2.62 | 0.199 | 0.222 | A | 479.0 | 351.0 | 8 | 28 | 20 | 8 | [[249, 500]] | 1.0 | 9lbf | Homo sapiens | STE_PAK2_HUMAN | STE | 4.2e-92 | 314.4 | 1.0 | 257.0 | 257.0 | 385 | 386 | 387 | 389 | 391 | 278 | 294 | 298 | 365 | 367 | 366 | 368.0 | 425 | 413 | 408 | 407 | 406 | 405 | 404 | 403 | 402 | 324 | Serine/threonine-protein kinase PAK 2 |
| STE | PAK2 | PAK2_HUMAN | 9LBFB | Q13177 | 93 | 522 | 524.0 | No_ligand | No_ligand | Inactive | DFGin | 7.0308 | 16.6912 | BLBplus | -134.23, -173.46 | 72.48, 42.23 | -141.91, 145.41 | 70.0, 102.23 | 66.59, -144.55 | out-out | out | 11.2269 | Saltbr-out | 9.4629 | HRD-in | -79.1, -48.8 | 75.21, -20.52 | out-out-out | SNCooo | out-out | ActLoopNT-out | 12.1265 | ActLoopCT-out | nonTYR | APEdihe_aanio | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 122.12 | APE8-rot-in | 303.98 | APE67-dihe-out | -61.34, -24.51 | -89.78, 56.48 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | D368N | None | None | XRAY | 2.62 | 0.199 | 0.222 | B | 479.0 | 324.0 | 14 | 28 | 14 | 14 | [[249, 500]] | 1.0 | 9lbf | Homo sapiens | STE_PAK2_HUMAN | STE | 4.2e-92 | 314.4 | 1.0 | 257.0 | 257.0 | 385 | 386 | 387 | 389 | 391 | 278 | 294 | 298 | 365 | 367 | 366 | 368.0 | 425 | 413 | 408 | 407 | 406 | 405 | 404 | 403 | 402 | 324 | Serine/threonine-protein kinase PAK 2 |
| 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 |
|---|