MolNFT v1 · #158461 · protein
HIV-1 integrase catalytic core domain complexed with allosteric inhibitor bi-224436
6NUJ: “HIV-1 integrase catalytic core domain complexed with allosteric inhibitor bi-224436”. X-ray diffraction, 1 ligand (L3D). MolNFT v1 #158461 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6NUJ
- Type
- protein
- Length
- 131 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- F2WR52
- Ligands
- L3D
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 131 | — | F2WR52 |
Ligands and binding sites
- L3D · (2S)-tert-butoxy[4-(2,3-dihydropyrano[4,3,2-de]quinolin-7-yl)-2-methylquinolin-3-yl]acetic acid · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6NUJ · HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor BI-224436 · 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 F2WR52
- Elsewhere: RCSB PDB 6NUJ · PDBe 6NUJ · UniProt F2WR52
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