MolNFT v1 · #60371 · protein

Crystal structure of ketosteroid isomerase D40N with bound 2- fluorophenol

3CPO · DELTA(5)-3-ketosteroid isomerase: “Crystal structure of ketosteroid isomerase D40N with bound 2- fluorophenol”. X-ray diffraction, 1 ligand (FP2), 1 pocket (best druggability 0.62). MolNFT v1 #60371 on GenesisL1: 3D structure…

PDB: 3CPO
Type: protein
Length: 122 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: DELTA(5)-3-ketosteroid isomerase
EC: 5.3.3.1
UniProt: P07445
Ligands: FP2
Pockets: 1 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 41% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	DELTA(5)-3-ketosteroid isomerase (EC 5.3.3.1)	protein	122	32% helix, 41% strand	P07445

Ligands and binding sites

FP2 · 2-fluorophenol · 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	173	0.62	0.83	23	FP2

Compared structures

3CPO · Crystal structure of ketosteroid isomerase D40N with bound 2-fluorophenol · 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 P07445
Elsewhere: RCSB PDB 3CPO · PDBe 3CPO · UniProt P07445

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