MolNFT v1 · #165707 · protein
Structure-based discovery of a novel small-molecule inhibitor of methicillin-resistant S. aureus
6U3Y: “Structure-based discovery of a novel small-molecule inhibitor of methicillin-resistant S. aureus”. X-ray diffraction, 2 ligands (PQJ, SO4). MolNFT v1 #165707 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6U3Y
- Type
- protein
- Length
- 816 residues
- Chains
- 3
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- Q5FBD2, B1Q017
- Ligands
- PQJ, SO4
Structure
x-ray diffraction · 3 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 291 | — | Q5FBD2 |
| B | — | protein | 270 | — | B1Q017 |
| D | — | protein | 255 | — | B1Q017 |
Ligands and binding sites
- PQJ · fos-choline-14 · ligand · 3 copies · chains A
- SO4 · Sulfate ion · ion · 16 copies · chains A, B, D
- ACT · Acetate ion · additive · 8 copies · chains A, B, D
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6U3Y · Structure-based discovery of a novel small-molecule inhibitor of methicillin-resistant S.… · 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 Q5FBD2
- Every structure of UniProt B1Q017
- Elsewhere: RCSB PDB 6U3Y · PDBe 6U3Y · UniProt Q5FBD2 · UniProt B1Q017
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.