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MolNFT v2 · #152563 · protein

EthR2 in complex with compound 5 (BDM71847)

6HS0: “EthR2 in complex with compound 5 (BDM71847)”. X-ray diffraction at 1.45, 1 ligand (GNW). MolNFT v2 #152563 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6HS0
Type
protein
Length
395 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.45
Source
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
UniProt
O53623
Ligands
GNW

Structure

x-ray diffraction · resolution 1.45 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein194—O53623
B—protein201—O53623

Ligands and binding sites

  • GNW · 1-[(3-chlorophenyl)methyl]piperazine · ligand · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6HS0 · ETHR2 in complex with compound 5 (BDM71847) · the same entry in another collection · chain A against A, TM-score 1.00

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