MolNFT v1 · #177977 · protein

Crystal structure of selenomethionine-labeled isomerase nsrq

7F0O: “Crystal structure of selenomethionine-labeled isomerase nsrq”. X-ray diffraction, 2 pockets (best druggability 0.77). MolNFT v1 #177977 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 7F0O
Type: protein
Length: 293 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Nsrq
UniProt: A0A2I1C3W8
Pockets: 2 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 39% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Nsrq	protein	144	37% helix, 40% strand	A0A2I1C3W8
B	Nsrq	protein	149	38% helix, 38% strand	A0A2I1C3W8

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	234	0.77	0.90	37	empty
2	465	0.75	0.83	48	empty

Interfaces

1 interface between chains.

A–B · 1165 Å² buried · 22 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 modified (engineered).

Compared structures

7F0O · Crystal structure of selenomethionine-labeled isomerase NsrQ · 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 A0A2I1C3W8
Elsewhere: RCSB PDB 7F0O · PDBe 7F0O · UniProt A0A2I1C3W8

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