| 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 | 6SRHA | Q04771 | 201 | 499 | 509.0 | LU8:501 | Type1 | Inactive | DFGin | 8.3373 | 13.4422 | BLAminus | -122.57, 162.03 | 75.26, 88.46 | -99.42, 24.23 | 300.0, 175.86 | -68.83, -17.25 | in-out | in | 9.2713 | Saltbr-out | 6.1836 | HRD-in | -78.85, -52.97 | 79.59, -0.55 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9523 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -120.6, 171.91 | APE9-dihe-na | -65.69, 166.15 | APE8-dihe-in | -64.37, 126.3 | APE8-rot-in | 301.19 | APE67-dihe-in | -57.05, -29.89 | -63.28, -37.95 | APE12-dist-in | 10.9956 | APE11-dist-out | 6.191 | APE10-dist-out | 8.8899 | APE9-dist-in | 3.6719 | Q207D | None | None | XRAY | 1.25 | 0.134 | 0.16 | A | 301.0 | 288.0 | 11 | 32 | 21 | 11 | [[207, 497]] | 1.0 | 6srh | 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 | 6SRHB | Q04771 | 205 | 499 | 509.0 | LU8:501,LU8:502,LU8:503 | Type1,Allosteric,Allosteric | Inactive | DFGin | 6.9365 | 13.3915 | BLAminus | -126.84, 164.05 | 75.03, 87.93 | -100.83, 18.93 | 301.99, 177.59 | -71.89, -11.94 | in-out | in | 8.9116 | Saltbr-out | 4.7467 | HRD-in | -80.94, -52.46 | 80.13, -0.8 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9248 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -121.66, 165.78 | APE9-dihe-na | -63.94, 166.94 | APE8-dihe-in | -62.11, 128.55 | APE8-rot-in | 298.15 | APE67-dihe-in | -60.05, -27.13 | -57.77, -43.71 | APE12-dist-in | 10.3292 | APE11-dist-out | 6.1224 | APE10-dist-out | 9.0702 | APE9-dist-in | 3.8077 | Q207D | None | None | XRAY | 1.25 | 0.134 | 0.16 | B | 301.0 | 295.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6srh | 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 | 6SRHA | Q04771 | 201 | 499 | 509.0 | LU8:501 | Type1 | Inactive | DFGin | 8.3373 | 13.4422 | BLAminus | -122.57, 162.03 | 75.26, 88.46 | -99.42, 24.23 | 300.0, 175.86 | -68.83, -17.25 | in-out | in | 9.2713 | Saltbr-out | 6.1836 | HRD-in | -78.85, -52.97 | 79.59, -0.55 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9523 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -120.6, 171.91 | APE9-dihe-na | -65.69, 166.15 | APE8-dihe-in | -64.37, 126.3 | APE8-rot-in | 301.19 | APE67-dihe-in | -57.05, -29.89 | -63.28, -37.95 | APE12-dist-in | 10.9956 | APE11-dist-out | 6.191 | APE10-dist-out | 8.8899 | APE9-dist-in | 3.6719 | Q207D | None | None | XRAY | 1.25 | 0.134 | 0.16 | A | 301.0 | 288.0 | 11 | 32 | 21 | 11 | [[207, 497]] | 1.0 | 6srh | 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 | 6SRHB | Q04771 | 205 | 499 | 509.0 | LU8:501,LU8:502,LU8:503 | Type1,Allosteric,Allosteric | Inactive | DFGin | 6.9365 | 13.3915 | BLAminus | -126.84, 164.05 | 75.03, 87.93 | -100.83, 18.93 | 301.99, 177.59 | -71.89, -11.94 | in-out | in | 8.9116 | Saltbr-out | 4.7467 | HRD-in | -80.94, -52.46 | 80.13, -0.8 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.9248 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -121.66, 165.78 | APE9-dihe-na | -63.94, 166.94 | APE8-dihe-in | -62.11, 128.55 | APE8-rot-in | 298.15 | APE67-dihe-in | -60.05, -27.13 | -57.77, -43.71 | APE12-dist-in | 10.3292 | APE11-dist-out | 6.1224 | APE10-dist-out | 9.0702 | APE9-dist-in | 3.8077 | Q207D | None | None | XRAY | 1.25 | 0.134 | 0.16 | B | 301.0 | 295.0 | 0 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6srh | 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 |
|---|