MolNFT v1 · #57305 · protein

Cellotriose complex of the endoglucanase CEL5A from bacillus agaradherans at 1.6 a resolution

3A3H: “Cellotriose complex of the endoglucanase CEL5A from bacillus agaradherans at 1.6 a resolution”. X-ray diffraction, 2 ligands (BGC, GLC), 1 pocket (best druggability 0.43). MolNFT v1 #57305 on GenesisL1: 3D structure, binding sites…

PDB: 3A3H
Type: protein
Length: 300 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Endoglucanase
EC: 3.2.1.4
UniProt: O85465
Ligands: BGC, GLC
Pockets: 1 · best druggability 0.43

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 19% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Endoglucanase (EC 3.2.1.4)	protein	300	40% helix, 19% strand	O85465

Ligands and binding sites

BGC · beta-D-glucopyranose · sugar · 2 copies · chains A
GLC · alpha-D-glucopyranose · sugar · 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, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	107	0.43	0.78	23	GLC, BGC

Compared structures

3A3H · Cellotriose complex of the endoglucanase CEL5A from bacillus agaradherans at 1.6 a… · the same entry in another collection · chain A against A, TM-score 1.00
O85465 · AlphaFold monomer V2.0 prediction for endoglucanase 5A (O85465) · a predicted model of the same protein · 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 O85465
Elsewhere: RCSB PDB 3A3H · PDBe 3A3H · UniProt O85465

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