MolNFT v2 · #152559 · protein
EthR2 in complex with compound 1 (BDM14272)
6HRW: “EthR2 in complex with compound 1 (BDM14272)”. X-ray diffraction at 2.45, 1 ligand (GNK). MolNFT v2 #152559 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6HRW
- Type
- protein
- Length
- 384 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v2 / PDB Bank
- Contract
- 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
- Owner
- 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
- Resolution
- 2.45
- Source
- Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
- UniProt
- O53623
- Ligands
- GNK
Structure
x-ray diffraction · resolution 2.45 · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 191 | — | O53623 |
| B | — | protein | 193 | — | O53623 |
Ligands and binding sites
- GNK · (1~{S},5~{R})-8-[2-(4-chlorophenyl)ethyl]-8-azabicyclo[3.2.1]octan-3-one · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6HRW · ETHR2 in complex with compound 1 (BDM14272) · 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 O53623
- Elsewhere: RCSB PDB 6HRW · PDBe 6HRW · UniProt O53623
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