MolNFT v1 · #52888 · protein

Crystal structure of RV0371C from mycobacterium tuberculosis H37RV

2WE9 · Moba-related protein: “Crystal structure of RV0371C from mycobacterium tuberculosis H37RV”. X-ray diffraction, 4 pockets (best druggability 0.67). MolNFT v1 #52888 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 2WE9
Type: protein
Length: 384 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Moba-related protein
UniProt: O53706
Pockets: 4 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 26% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Moba-related protein	protein	190	31% helix, 25% strand	O53706
B	Moba-related protein	protein	194	35% helix, 26% strand	O53706

Ligands and binding sites

GOL · Glycerol · additive · chains A

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	302	0.67	0.82	38	empty
2	369	0.62	0.78	41	GOL
3	251	0.54	0.77	35	empty
4	72	0.36	0.77	13	empty

Interfaces

1 interface between chains.

A–B · 454 Å² buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 7 modified (engineered).

Compared structures

2WE9 · Crystal structure of Rv0371c from Mycobacterium tuberculosis H37Rv · 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 O53706
Elsewhere: RCSB PDB 2WE9 · PDBe 2WE9 · UniProt O53706

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