| 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 | ACVR1 | ACVR1_HUMAN | 3MTFA | Q04771 | 203 | 498 | 509.0 | A3F:1 | Type1 | Inactive | DFGin | 7.0905 | 13.2083 | BLAminus | -126.1, 157.67 | 76.9, 82.69 | -86.05, 21.36 | 306.23, 175.03 | -61.66, -24.97 | in-out | in | 8.3313 | Saltbr-out | 4.1956 | HRD-in | -82.54, -58.57 | 79.29, -1.49 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9128 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -103.22, 162.67 | APE9-dihe-na | -69.88, 165.81 | APE8-dihe-in | -53.93, 121.99 | APE8-rot-in | 312.82 | APE67-dihe-in | -59.42, -28.32 | -57.34, -37.41 | APE12-dist-in | 10.6706 | APE11-dist-out | 6.476 | APE10-dist-out | 9.4819 | APE9-dist-in | 4.0726 | Q207D | None | None | XRAY | 2.15 | 0.185 | 0.244 | A | 301.0 | 296.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 3mtf | TKL_ACVR1_HUMAN | TKL | 1.9e-85 | 292.5 | 2.0 | 267.0 | 266.0 | 353 | 354 | 355 | 357 | 359 | 235 | 248 | 252 | 333 | 335 | 334 | 336.0 | 403 | 385 | 380 | 379 | 378 | 377 | 376 | 375 | 374 | 284 | Activin receptor type-1 |
| TKL | ACVR1 | ACVR1_HUMAN | 3MTFB | Q04771 | 202 | 499 | 509.0 | A3F:501 | Type1 | Inactive | DFGin | 7.5781 | 13.3226 | BLAminus | -114.45, 160.06 | 82.35, 87.49 | -104.83, 25.86 | 291.12, 164.81 | -75.29, -13.54 | in-out | in | 8.5 | Saltbr-out | 4.2324 | HRD-in | -82.5, -60.12 | 85.3, -4.39 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.869 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -111.75, 153.3 | APE9-dihe-na | -57.45, 170.81 | APE8-dihe-in | -65.39, 131.64 | APE8-rot-in | 306.28 | APE67-dihe-in | -49.77, -35.33 | -68.1, -43.23 | APE12-dist-in | 10.6109 | APE11-dist-out | 6.4527 | APE10-dist-out | 9.3963 | APE9-dist-in | 4.1192 | Q207D | None | None | XRAY | 2.15 | 0.185 | 0.244 | B | 301.0 | 298.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 3mtf | TKL_ACVR1_HUMAN | TKL | 1.9e-85 | 292.5 | 2.0 | 267.0 | 266.0 | 353 | 354 | 355 | 357 | 359 | 235 | 248 | 252 | 333 | 335 | 334 | 336.0 | 403 | 385 | 380 | 379 | 378 | 377 | 376 | 375 | 374 | 284 | Activin receptor type-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 | ACVR1 | ACVR1_HUMAN | 3MTFA | Q04771 | 203 | 498 | 509.0 | A3F:1 | Type1 | Inactive | DFGin | 7.0905 | 13.2083 | BLAminus | -126.1, 157.67 | 76.9, 82.69 | -86.05, 21.36 | 306.23, 175.03 | -61.66, -24.97 | in-out | in | 8.3313 | Saltbr-out | 4.1956 | HRD-in | -82.54, -58.57 | 79.29, -1.49 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9128 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -103.22, 162.67 | APE9-dihe-na | -69.88, 165.81 | APE8-dihe-in | -53.93, 121.99 | APE8-rot-in | 312.82 | APE67-dihe-in | -59.42, -28.32 | -57.34, -37.41 | APE12-dist-in | 10.6706 | APE11-dist-out | 6.476 | APE10-dist-out | 9.4819 | APE9-dist-in | 4.0726 | Q207D | None | None | XRAY | 2.15 | 0.185 | 0.244 | A | 301.0 | 296.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 3mtf | Homo sapiens | TKL_ACVR1_HUMAN | TKL | 1.9e-85 | 292.5 | 2.0 | 267.0 | 266.0 | 353 | 354 | 355 | 357 | 359 | 235 | 248 | 252 | 333 | 335 | 334 | 336.0 | 403 | 385 | 380 | 379 | 378 | 377 | 376 | 375 | 374 | 284 | Activin receptor type-1 |
| TKL | ACVR1 | ACVR1_HUMAN | 3MTFB | Q04771 | 202 | 499 | 509.0 | A3F:501 | Type1 | Inactive | DFGin | 7.5781 | 13.3226 | BLAminus | -114.45, 160.06 | 82.35, 87.49 | -104.83, 25.86 | 291.12, 164.81 | -75.29, -13.54 | in-out | in | 8.5 | Saltbr-out | 4.2324 | HRD-in | -82.5, -60.12 | 85.3, -4.39 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.869 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -111.75, 153.3 | APE9-dihe-na | -57.45, 170.81 | APE8-dihe-in | -65.39, 131.64 | APE8-rot-in | 306.28 | APE67-dihe-in | -49.77, -35.33 | -68.1, -43.23 | APE12-dist-in | 10.6109 | APE11-dist-out | 6.4527 | APE10-dist-out | 9.3963 | APE9-dist-in | 4.1192 | Q207D | None | None | XRAY | 2.15 | 0.185 | 0.244 | B | 301.0 | 298.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 3mtf | Homo sapiens | TKL_ACVR1_HUMAN | TKL | 1.9e-85 | 292.5 | 2.0 | 267.0 | 266.0 | 353 | 354 | 355 | 357 | 359 | 235 | 248 | 252 | 333 | 335 | 334 | 336.0 | 403 | 385 | 380 | 379 | 378 | 377 | 376 | 375 | 374 | 284 | Activin receptor type-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 |
|---|