| 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 | 6UNSA | Q04771 | 204 | 496 | 509.0 | LDN:501 | Type1 | Inactive | DFGin | 7.2245 | 12.856 | BLAminus | -117.56, 173.67 | 72.35, 88.75 | -102.95, 22.4 | 297.93, 174.62 | -66.2, -23.82 | in-in | in | 8.1047 | Saltbr-in | 2.9799 | HRD-in | -81.6, -59.03 | 82.63, -0.45 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8135 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -93.62, 142.8 | APE9-dihe-na | -63.9, 171.12 | APE8-dihe-in | -66.39, 123.82 | APE8-rot-in | 304.97 | APE67-dihe-in | -58.01, -31.11 | -66.21, -35.39 | APE12-dist-in | 10.4919 | APE11-dist-out | 6.5579 | APE10-dist-out | 10.0049 | APE9-dist-in | 4.5081 | K492A,K493A | None | None | XRAY | 2.3 | 0.215 | 0.262 | A | 330.0 | 288.0 | 6 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6uns | TKL_ACVR1_HUMAN | TKL | 7.3e-85 | 290.8 | 2.0 | 266.0 | 265.0 | 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 | 6UNSB | Q04771 | 204 | 496 | 509.0 | LDN:501 | Type1 | Inactive | DFGin | 7.7092 | 12.7355 | BLAminus | -118.56, 173.66 | 72.39, 85.71 | -105.41, 24.1 | 306.63, 13.91 | -67.87, -22.75 | in-out | in | 8.2348 | Saltbr-out | 3.8781 | HRD-in | -80.19, -57.75 | 81.06, 0.8 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7719 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -97.69, 138.7 | APE9-dihe-na | -64.83, 170.36 | APE8-dihe-in | -65.69, 123.25 | APE8-rot-in | 313.39 | APE67-dihe-in | -58.4, -31.45 | -67.8, -32.39 | APE12-dist-in | 10.4791 | APE11-dist-out | 6.4077 | APE10-dist-out | 9.8702 | APE9-dist-in | 4.5616 | K492A,K493A | None | None | XRAY | 2.3 | 0.215 | 0.262 | B | 330.0 | 290.0 | 4 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6uns | TKL_ACVR1_HUMAN | TKL | 7.3e-85 | 290.8 | 2.0 | 266.0 | 265.0 | 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 | 6UNSA | Q04771 | 204 | 496 | 509.0 | LDN:501 | Type1 | Inactive | DFGin | 7.2245 | 12.856 | BLAminus | -117.56, 173.67 | 72.35, 88.75 | -102.95, 22.4 | 297.93, 174.62 | -66.2, -23.82 | in-in | in | 8.1047 | Saltbr-in | 2.9799 | HRD-in | -81.6, -59.03 | 82.63, -0.45 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8135 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -93.62, 142.8 | APE9-dihe-na | -63.9, 171.12 | APE8-dihe-in | -66.39, 123.82 | APE8-rot-in | 304.97 | APE67-dihe-in | -58.01, -31.11 | -66.21, -35.39 | APE12-dist-in | 10.4919 | APE11-dist-out | 6.5579 | APE10-dist-out | 10.0049 | APE9-dist-in | 4.5081 | K492A,K493A | None | None | XRAY | 2.3 | 0.215 | 0.262 | A | 330.0 | 288.0 | 6 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6uns | Homo sapiens | TKL_ACVR1_HUMAN | TKL | 7.3e-85 | 290.8 | 2.0 | 266.0 | 265.0 | 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 | 6UNSB | Q04771 | 204 | 496 | 509.0 | LDN:501 | Type1 | Inactive | DFGin | 7.7092 | 12.7355 | BLAminus | -118.56, 173.66 | 72.39, 85.71 | -105.41, 24.1 | 306.63, 13.91 | -67.87, -22.75 | in-out | in | 8.2348 | Saltbr-out | 3.8781 | HRD-in | -80.19, -57.75 | 81.06, 0.8 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.7719 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -97.69, 138.7 | APE9-dihe-na | -64.83, 170.36 | APE8-dihe-in | -65.69, 123.25 | APE8-rot-in | 313.39 | APE67-dihe-in | -58.4, -31.45 | -67.8, -32.39 | APE12-dist-in | 10.4791 | APE11-dist-out | 6.4077 | APE10-dist-out | 9.8702 | APE9-dist-in | 4.5616 | K492A,K493A | None | None | XRAY | 2.3 | 0.215 | 0.262 | B | 330.0 | 290.0 | 4 | 32 | 32 | 0 | [[207, 497]] | 1.0 | 6uns | Homo sapiens | TKL_ACVR1_HUMAN | TKL | 7.3e-85 | 290.8 | 2.0 | 266.0 | 265.0 | 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 |
|---|