| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | LIMK1 | LIMK1_HUMAN | AF-P53667-K1A | P53667 | 331 | 614 | 647.0 | No_ligand | No_ligand | Active | DFGin | 6.4021 | 13.541 | BLAminus | -132.91, 172.92 | 63.45, 83.32 | -95.59, 15.47 | 307.89, 98.1 | -56.0, -37.92 | in-in | in | 8.0035 | Saltbr-in | 2.8756 | HRD-in | -72.18, -46.62 | 65.68, -7.95 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8147 | ActLoopCT-in | nonTYR | APEdihe_aaiai | APEdist_iiii | APE10-dihe-na | -147.55, 162.1 | APE9-dihe-na | 111.74, 171.85 | APE8-dihe-in | -70.23, 125.79 | APE8-rot-na | 190.49 | APE67-dihe-in | -72.63, -29.87 | -60.16, -27.98 | APE12-dist-in | 8.9723 | APE11-dist-in | 11.3112 | APE10-dist-in | 5.6992 | APE9-dist-in | 3.7416 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 284.0 | 284.0 | 0 | 42 | 42 | 0 | [[339, 606]] | 1.0 | AF-P53667-K1 | TKL_LIMK1_HUMAN | TKL | 3.2e-77 | 265.6 | 3.0 | 266.0 | 264.0 | 477 | 478 | 479 | 481 | 483 | 368 | 384 | 388 | 457 | 459 | 458 | 460.0 | 531 | 519 | 514 | 513 | 512 | 511 | 510 | 509 | 508 | 414 | LIM domain kinase 1 |
| TKL | LIMK1 | LIMK1_HUMAN | AF-P53667-K3A | P53667 | 331 | 614 | 647.0 | No_ligand | No_ligand | Active | DFGin | 6.4364 | 13.0013 | BLAminus | -134.63, 176.85 | 57.56, 81.2 | -91.01, 15.28 | 308.67, 101.9 | -59.38, -29.77 | in-in | in | 8.4189 | Saltbr-in | 2.7623 | HRD-in | -76.02, -44.69 | 64.99, -9.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8487 | ActLoopCT-in | nonTYR | APEdihe_aaiai | APEdist_iiii | APE10-dihe-na | -146.38, 153.96 | APE9-dihe-na | 114.91, -178.52 | APE8-dihe-in | -81.56, 123.45 | APE8-rot-na | 187.77 | APE67-dihe-in | -69.46, -22.15 | -58.27, -25.04 | APE12-dist-in | 9.6764 | APE11-dist-in | 11.3408 | APE10-dist-in | 5.6872 | APE9-dist-in | 4.083 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 284.0 | 284.0 | 0 | 42 | 42 | 0 | [[339, 606]] | 1.0 | AF-P53667-K3 | TKL_LIMK1_HUMAN | TKL | 3.2e-77 | 265.6 | 3.0 | 266.0 | 264.0 | 477 | 478 | 479 | 481 | 483 | 368 | 384 | 388 | 457 | 459 | 458 | 460.0 | 531 | 519 | 514 | 513 | 512 | 511 | 510 | 509 | 508 | 414 | LIM domain kinase 1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | LIMK1 | LIMK1_HUMAN | AF-P53667-K1A | P53667 | 331 | 614 | 647.0 | No_ligand | No_ligand | Active | DFGin | 6.4021 | 13.541 | BLAminus | -132.91, 172.92 | 63.45, 83.32 | -95.59, 15.47 | 307.89, 98.1 | -56.0, -37.92 | in-in | in | 8.0035 | Saltbr-in | 2.8756 | HRD-in | -72.18, -46.62 | 65.68, -7.95 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8147 | ActLoopCT-in | nonTYR | APEdihe_aaiai | APEdist_iiii | APE10-dihe-na | -147.55, 162.1 | APE9-dihe-na | 111.74, 171.85 | APE8-dihe-in | -70.23, 125.79 | APE8-rot-na | 190.49 | APE67-dihe-in | -72.63, -29.87 | -60.16, -27.98 | APE12-dist-in | 8.9723 | APE11-dist-in | 11.3112 | APE10-dist-in | 5.6992 | APE9-dist-in | 3.7416 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 284.0 | 284.0 | 0 | 42 | 42 | 0 | [[339, 606]] | 1.0 | AF-P53667-K1 | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 3.2e-77 | 265.6 | 3.0 | 266.0 | 264.0 | 477 | 478 | 479 | 481 | 483 | 368 | 384 | 388 | 457 | 459 | 458 | 460.0 | 531 | 519 | 514 | 513 | 512 | 511 | 510 | 509 | 508 | 414 | LIM domain kinase 1 |
| TKL | LIMK1 | LIMK1_HUMAN | AF-P53667-K3A | P53667 | 331 | 614 | 647.0 | No_ligand | No_ligand | Active | DFGin | 6.4364 | 13.0013 | BLAminus | -134.63, 176.85 | 57.56, 81.2 | -91.01, 15.28 | 308.67, 101.9 | -59.38, -29.77 | in-in | in | 8.4189 | Saltbr-in | 2.7623 | HRD-in | -76.02, -44.69 | 64.99, -9.59 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8487 | ActLoopCT-in | nonTYR | APEdihe_aaiai | APEdist_iiii | APE10-dihe-na | -146.38, 153.96 | APE9-dihe-na | 114.91, -178.52 | APE8-dihe-in | -81.56, 123.45 | APE8-rot-na | 187.77 | APE67-dihe-in | -69.46, -22.15 | -58.27, -25.04 | APE12-dist-in | 9.6764 | APE11-dist-in | 11.3408 | APE10-dist-in | 5.6872 | APE9-dist-in | 4.083 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 284.0 | 284.0 | 0 | 42 | 42 | 0 | [[339, 606]] | 1.0 | AF-P53667-K3 | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 3.2e-77 | 265.6 | 3.0 | 266.0 | 264.0 | 477 | 478 | 479 | 481 | 483 | 368 | 384 | 388 | 457 | 459 | 458 | 460.0 | 531 | 519 | 514 | 513 | 512 | 511 | 510 | 509 | 508 | 414 | LIM domain kinase 1 |
| 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 |
|---|