Xchem group deposition -- crystal structure of human ACVR1 in complex with FM000329D

Structure

x-ray diffraction · 2 distinct chains.

Ligands and binding sites

• LU8 · 4-methyl-3-[4-(1-methylpiperidin-4-yl)phenyl]-5-(3,4,5-trimethoxyphenyl)pyridine · ligand · 4 copies · chains A, B
• XH7 · (3R)-thiolane-3-carboxylic acid · ligand · 3 copies · chains A, B
• SO4 · Sulfate ion · ion · 5 copies · chains A, B
• EDO · 1,2-ethanediol · additive · 12 copies · chains A, B
• DMS · Dimethyl sulfoxide · additive · 2 copies · chains A, B
• TAR · D(-)-tartaric acid · additive · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

• 5S7B · XChem group deposition -- Crystal Structure of human ACVR1 in complex with FM000329d · the same entry in another collection · chain A against A, TM-score 1.00
• Q04771 · AlphaFold monomer V2.0 prediction for activin receptor type-1 (Q04771) · a predicted model of the same protein · chain A against A, TM-score 0.95

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt Q04771
• Elsewhere: RCSB PDB 5S7B · PDBe 5S7B · UniProt Q04771