MolNFT v2 · #157747 · protein
X-ray crystal structure of wild type HIV-1 protease in complex with GRL-001
6MCR: “X-ray crystal structure of wild type HIV-1 protease in complex with GRL-001”. X-ray diffraction at 1.48, 1 ligand (JDY). MolNFT v2 #157747 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6MCR
- Type
- protein
- Length
- 99 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v2 / PDB Bank
- Contract
- 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
- Owner
- 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
- Resolution
- 1.48
- Source
- Human immunodeficiency virus 1
- UniProt
- Q8ULI2
- Ligands
- JDY
Structure
x-ray diffraction · resolution 1.48 · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 99 | — | Q8ULI2 |
Ligands and binding sites
- JDY · (3S,3aR,5R,7aS,8S)-hexahydro-4H-3,5-methanofuro[2,3-b]pyran-8-yl [(2S,3R)-4-[{[2-(cyclopropylamino)-1,3-benzothiazol-6-yl]sulfonyl}(2-methylpropyl)amino]-1-(3-fluorophenyl)-3-hydroxybutan-2-yl]carbamate · ligand · chains A
- EDO · 1,2-ethanediol · additive · 3 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6MCR · X-ray crystal structure of wild type HIV-1 protease in complex with grl-001 · 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 Q8ULI2
- Elsewhere: RCSB PDB 6MCR · PDBe 6MCR · UniProt Q8ULI2
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