| 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 | ACVR2A | AVR2A_HUMAN | 3Q4TA | P27037 | 191 | 484 | 513.0 | TAK:60002 | Type1 | Inactive | DFGin | 7.5736 | 14.0966 | BLAminus | -123.56, 165.6 | 68.53, 85.67 | -104.01, 23.68 | 300.6, 98.11 | -61.19, -27.21 | in-in | in | 8.2168 | Saltbr-in | 2.797 | HRD-in | -88.26, -44.7 | 74.99, 6.75 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8743 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -135.25, 165.71 | APE9-dihe-na | -78.55, -169.19 | APE8-dihe-in | -70.65, 121.11 | APE8-rot-in | 308.48 | APE67-dihe-in | -46.78, -36.2 | -40.9, -55.96 | APE12-dist-in | 10.3422 | APE11-dist-out | 6.2827 | APE10-dist-out | 8.8817 | APE9-dist-in | 3.5295 | None | None | None | XRAY | 1.96 | 0.171 | 0.223 | A | 322.0 | 294.0 | 0 | 30 | 30 | 0 | [[192, 481]] | 1.0 | 3q4t | TKL_ACVR2A_HUMAN | TKL | 3.5e-83 | 285.1 | 2.0 | 266.0 | 265.0 | 339 | 340 | 341 | 343 | 345 | 219 | 232 | 236 | 319 | 321 | 320 | 322.0 | 386 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 268 | Activin receptor type-2A |
| TKL | ACVR2A | AVR2A_HUMAN | 3Q4TB | P27037 | 191 | 485 | 513.0 | TAK:60001 | Type1 | Active | DFGin | 7.5844 | 13.7734 | BLAminus | -128.74, 167.36 | 69.0, 93.18 | -108.05, 19.83 | 304.44, 108.16 | -60.68, -27.36 | in-in | in | 8.091 | Saltbr-in | 2.7887 | HRD-in | -87.27, -46.41 | 76.78, -1.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8357 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -109.89, -26.02 | APE9-dihe-na | -85.65, -161.16 | APE8-dihe-in | -82.47, 131.09 | APE8-rot-in | 297.46 | APE67-dihe-in | -64.09, -26.22 | -62.33, -41.13 | APE12-dist-in | 10.9477 | APE11-dist-in | 12.4473 | APE10-dist-in | 6.4709 | APE9-dist-in | 3.4539 | None | None | None | XRAY | 1.96 | 0.171 | 0.223 | B | 322.0 | 293.0 | 2 | 30 | 28 | 2 | [[192, 481]] | 1.0 | 3q4t | TKL_ACVR2A_HUMAN | TKL | 3.5e-83 | 285.1 | 2.0 | 266.0 | 265.0 | 339 | 340 | 341 | 343 | 345 | 219 | 232 | 236 | 319 | 321 | 320 | 322.0 | 386 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 268 | Activin receptor type-2A |
| 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 | ACVR2A | AVR2A_HUMAN | 3Q4TA | P27037 | 191 | 484 | 513.0 | TAK:60002 | Type1 | Inactive | DFGin | 7.5736 | 14.0966 | BLAminus | -123.56, 165.6 | 68.53, 85.67 | -104.01, 23.68 | 300.6, 98.11 | -61.19, -27.21 | in-in | in | 8.2168 | Saltbr-in | 2.797 | HRD-in | -88.26, -44.7 | 74.99, 6.75 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8743 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iooi | APE10-dihe-na | -135.25, 165.71 | APE9-dihe-na | -78.55, -169.19 | APE8-dihe-in | -70.65, 121.11 | APE8-rot-in | 308.48 | APE67-dihe-in | -46.78, -36.2 | -40.9, -55.96 | APE12-dist-in | 10.3422 | APE11-dist-out | 6.2827 | APE10-dist-out | 8.8817 | APE9-dist-in | 3.5295 | None | None | None | XRAY | 1.96 | 0.171 | 0.223 | A | 322.0 | 294.0 | 0 | 30 | 30 | 0 | [[192, 481]] | 1.0 | 3q4t | Homo sapiens | TKL_ACVR2A_HUMAN | TKL | 3.5e-83 | 285.1 | 2.0 | 266.0 | 265.0 | 339 | 340 | 341 | 343 | 345 | 219 | 232 | 236 | 319 | 321 | 320 | 322.0 | 386 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 268 | Activin receptor type-2A |
| TKL | ACVR2A | AVR2A_HUMAN | 3Q4TB | P27037 | 191 | 485 | 513.0 | TAK:60001 | Type1 | Active | DFGin | 7.5844 | 13.7734 | BLAminus | -128.74, 167.36 | 69.0, 93.18 | -108.05, 19.83 | 304.44, 108.16 | -60.68, -27.36 | in-in | in | 8.091 | Saltbr-in | 2.7887 | HRD-in | -87.27, -46.41 | 76.78, -1.51 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8357 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -109.89, -26.02 | APE9-dihe-na | -85.65, -161.16 | APE8-dihe-in | -82.47, 131.09 | APE8-rot-in | 297.46 | APE67-dihe-in | -64.09, -26.22 | -62.33, -41.13 | APE12-dist-in | 10.9477 | APE11-dist-in | 12.4473 | APE10-dist-in | 6.4709 | APE9-dist-in | 3.4539 | None | None | None | XRAY | 1.96 | 0.171 | 0.223 | B | 322.0 | 293.0 | 2 | 30 | 28 | 2 | [[192, 481]] | 1.0 | 3q4t | Homo sapiens | TKL_ACVR2A_HUMAN | TKL | 3.5e-83 | 285.1 | 2.0 | 266.0 | 265.0 | 339 | 340 | 341 | 343 | 345 | 219 | 232 | 236 | 319 | 321 | 320 | 322.0 | 386 | 369 | 364 | 363 | 362 | 361 | 360 | 359 | 358 | 268 | Activin receptor type-2A |
| 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 |
|---|