MolNFT v1 · #136029 · protein

Crystal structure of ketosteroid isomerase D38GF54A mutant from pseudomonas testosteroni (tksi) bound to equilenin

5UGI · Steroid delta-isomerase: “Crystal structure of ketosteroid isomerase D38GF54A mutant from pseudomonas testosteroni (tksi) bound to…”. X-ray diffraction, 1 ligand (EQU), 1 pocket (best druggability 0.62). MolNFT v1 #136029 on…

PDB: 5UGI
Type: protein
Length: 124 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Steroid delta-isomerase
EC: 5.3.3.1
UniProt: P00947
Ligands: EQU
Pockets: 1 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 29% helix, 40% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Steroid delta-isomerase (EC 5.3.3.1)	protein	124	29% helix, 40% strand	P00947

Ligands and binding sites

EQU · Equilenin · ligand · chains A

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

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	261	0.62	0.80	27	EQU

Compared structures

5UGI · Crystal Structure of Ketosteroid Isomerase D38GF54A mutant from Pseudomonas Testosteroni… · the same entry in another collection · chain A against A, TM-score 1.00
P00947 · AlphaFold monomer V2.0 prediction for steroid delta-isomerase (P00947) · a predicted model of the same protein · chain A against A, TM-score 0.97

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 P00947
Elsewhere: RCSB PDB 5UGI · PDBe 5UGI · UniProt P00947

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