MolNFT v1 · #157292 · protein
Crystal structure of HIV-1 B41 SOSIP.664 prefusion env trimer bound to small molecule HIV-1 entry inhibitor bms-386150 in complex with human antibodies 3H109L and 35O22 at 3.8 ångström
6MUG: “Crystal structure of HIV-1 B41 SOSIP.664 prefusion env trimer bound to small molecule HIV-1 entry inhibitor…”. X-ray diffraction, 4 ligands (JYS, NAG, MAN). MolNFT v1 #157292 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 6MUG
- Type
- protein
- Length
- 1,225 residues
- Chains
- 6
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- B3UEZ6, B3UES2
- Ligands
- JYS, NAG, MAN, BMA
Structure
x-ray diffraction · 6 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| B | — | protein | 123 | — | B3UEZ6 |
| D | — | protein | 128 | — | — |
| E | — | protein | 112 | — | — |
| G | — | protein | 424 | — | B3UES2 |
| H | — | protein | 227 | — | — |
| L | — | protein | 211 | — | — |
Ligands and binding sites
- JYS · 1-[4-(benzenecarbonyl)piperazin-1-yl]-2-(4-bromo-7-fluoro-1H-indol-3-yl)ethane-1,2-dione · ligand · chains G
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 22 copies · chains B, D, G, L, H
- MAN · alpha-D-mannopyranose · sugar · 10 copies · chains D, E, H, L
- BMA · beta-D-mannopyranose · sugar · 2 copies · chains D, E, H
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6MUG · Crystal Structure of HIV-1 B41 SOSIP.664 Prefusion Env Trimer Bound to Small Molecule… · the same entry in another collection · chain B against B, 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 B3UEZ6
- Every structure of UniProt B3UES2
- Elsewhere: RCSB PDB 6MUG · PDBe 6MUG · UniProt B3UEZ6 · UniProt B3UES2
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