MolNFT v1 · #169029 · protein

Crystal structure of ECHA19, enoyl-CoA hydratase from mycobacterium tuberculosis

6WYI: “Crystal structure of ECHA19, enoyl-CoA hydratase from mycobacterium tuberculosis”. X-ray diffraction, 1 ligand (MG), 1 pocket (best druggability 0.35). MolNFT v1 #169029 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6WYI
Type: protein
Length: 237 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: ECHA19, enoyl-CoA hydratase
UniProt: O53561
Ligands: MG
Pockets: 1 · best druggability 0.35

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 16% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	ECHA19, enoyl-CoA hydratase	protein	237	45% helix, 16% strand	O53561

Ligands and binding sites

MG · Magnesium ion · metal

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	112	0.35	0.73	18	empty

Compared structures

6WYI · Crystal structure of EchA19, enoyl-CoA hydratase from Mycobacterium tuberculosis · 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 O53561
Elsewhere: RCSB PDB 6WYI · PDBe 6WYI · UniProt O53561

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