| 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 | 7B8WA | P53667 | 330 | 633 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.6661 | 11.4926 | BBAminus | -108.83, 173.28 | -137.19, 82.52 | -63.27, -30.52 | 292.34, 152.89 | -108.41, 12.13 | out-out | out | 15.4181 | Saltbr-out | 15.2387 | HRD-in | -60.02, -54.69 | 66.73, -7.71 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.2286 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 173.73 | APE8-rot-na | 249.62 | APE67-dihe-in | -62.65, -17.18 | -62.83, -26.22 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | A | 310.0 | 279.0 | 25 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WB | P53667 | 330 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.7675 | 11.0591 | BBAminus | -106.35, 172.19 | -132.14, 77.15 | -57.43, -29.76 | 284.14, 171.59 | -103.49, 0.05 | out-out | out | 15.4479 | Saltbr-out | 15.4371 | HRD-in | -64.64, -57.77 | 78.09, -18.57 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.5347 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 157.36 | APE8-rot-na | 234.58 | APE67-dihe-in | -57.94, -33.17 | -72.5, -19.71 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | B | 310.0 | 275.0 | 28 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WC | P53667 | 330 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.4887 | 11.2611 | BBAminus | -111.78, 177.07 | -146.46, 75.42 | -59.24, -37.03 | 298.62, 151.29 | -94.08, 6.16 | out-out | out | 15.4237 | Saltbr-out | 15.3287 | HRD-in | -60.88, -61.88 | 71.56, -6.41 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.3299 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -76.99, 161.6 | 999.0, -48.8 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | C | 310.0 | 276.0 | 27 | 42 | 16 | 26 | [[339, 606]] | 1.0 | 7b8w | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WD | P53667 | 331 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.7849 | 11.4189 | BBAminus | -104.89, 177.21 | -139.94, 82.99 | -62.41, -30.49 | 296.01, 157.77 | -99.63, 2.65 | out-out | out | 15.6383 | Saltbr-out | 15.3644 | HRD-in | -83.91, -55.17 | 72.93, -9.44 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.4525 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -172.92 | APE8-rot-na | 308.11 | APE67-dihe-in | -63.89, -29.07 | -79.57, -3.7 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | D | 310.0 | 273.0 | 29 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WA | P53667 | 330 | 633 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.6661 | 11.4926 | BBAminus | -108.83, 173.28 | -137.19, 82.52 | -63.27, -30.52 | 292.34, 152.89 | -108.41, 12.13 | out-out | out | 15.4181 | Saltbr-out | 15.2387 | HRD-in | -60.02, -54.69 | 66.73, -7.71 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.2286 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 173.73 | APE8-rot-na | 249.62 | APE67-dihe-in | -62.65, -17.18 | -62.83, -26.22 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | A | 310.0 | 279.0 | 25 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WB | P53667 | 330 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.7675 | 11.0591 | BBAminus | -106.35, 172.19 | -132.14, 77.15 | -57.43, -29.76 | 284.14, 171.59 | -103.49, 0.05 | out-out | out | 15.4479 | Saltbr-out | 15.4371 | HRD-in | -64.64, -57.77 | 78.09, -18.57 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.5347 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 157.36 | APE8-rot-na | 234.58 | APE67-dihe-in | -57.94, -33.17 | -72.5, -19.71 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | B | 310.0 | 275.0 | 28 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WC | P53667 | 330 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.4887 | 11.2611 | BBAminus | -111.78, 177.07 | -146.46, 75.42 | -59.24, -37.03 | 298.62, 151.29 | -94.08, 6.16 | out-out | out | 15.4237 | Saltbr-out | 15.3287 | HRD-in | -60.88, -61.88 | 71.56, -6.41 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.3299 | ActLoopCT-none | nonTYR | APEdihe_aannn | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, 999.0 | APE8-rot-none | 999.0 | APE67-dihe-none | -76.99, 161.6 | 999.0, -48.8 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | C | 310.0 | 276.0 | 27 | 42 | 16 | 26 | [[339, 606]] | 1.0 | 7b8w | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 | 7B8WD | P53667 | 331 | 632 | 647.0 | T3B:701 | Type2 | Inactive | DFGout | 16.7849 | 11.4189 | BBAminus | -104.89, 177.21 | -139.94, 82.99 | -62.41, -30.49 | 296.01, 157.77 | -99.63, 2.65 | out-out | out | 15.6383 | Saltbr-out | 15.3644 | HRD-in | -83.91, -55.17 | 72.93, -9.44 | out-out-none | SNCoon | out-none | ActLoopNT-out | 4.4525 | ActLoopCT-none | nonTYR | APEdihe_aanai | APEdist_nnnn | APE10-dihe-na | 999.0, 999.0 | APE9-dihe-na | 999.0, 999.0 | APE8-dihe-none | 999.0, -172.92 | APE8-rot-na | 308.11 | APE67-dihe-in | -63.89, -29.07 | -79.57, -3.7 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-none | 999.0 | APE9-dist-none | 999.0 | None | None | None | XRAY | 2.8 | 0.209 | 0.286 | D | 310.0 | 273.0 | 29 | 42 | 17 | 25 | [[339, 606]] | 1.0 | 7b8w | Homo sapiens | TKL_LIMK1_HUMAN | TKL | 4.5e-77 | 265.1 | 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 |
|---|