MolNFT v1 · #185836 · protein
Unexpected imidazole coordination to dirhodium tetraacetate complex in a protein environment: insights from X-ray crystallography and quantum chemistry
7QHR: “Unexpected imidazole coordination to dirhodium tetraacetate complex in a protein environment: insights from…”. X-ray diffraction, 4 ligands (D1O, D3I, CJI). MolNFT v1 #185836 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 7QHR
- Type
- protein
- Length
- 248 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P61823
- Ligands
- D1O, D3I, CJI, D5A
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | — | protein | 124 | — | P61823 |
Ligands and binding sites
- D1O · tri-(mi2-acetato-(O, O')-diaqua-dirhodium(II, II) · ligand · 2 copies · chains A, B
- D3I · octaaqua-dirhodium (II, II) fragment · ligand · chains A
- CJI · cis-mi2-acetato-(O, O')-N-imidazyl-pentaaqua-dirhodium(II, II) · ligand · chains A, B
- D5A · trans-mi2-acetato-(O, O')-N-imidazyl-pentaaqua-dirhodium(II, II) · ligand · chains B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7QHR · Unexpected imidazole coordination to dirhodium tetraacetate complex in a protein… · the same entry in another collection · chain A against A, TM-score 1.00
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 P61823
- Elsewhere: RCSB PDB 7QHR · PDBe 7QHR · UniProt P61823
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