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Endoglucanase I native structure

Analyse Endoglucanase I native structure in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3OVW
Type
protein
Length
800 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Endoglucanase I
EC
3.2.1.4
UniProt
P46237
Ligands
NAG
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 16% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BEndoglucanase I (EC 3.2.1.4)protein40016% helix, 35% strandP46237

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15810.700.7964empty
25640.690.7864empty
31620.470.7727empty
41530.440.7618empty
5520.260.7313empty

Interfaces

1 interface between chains.

  • A–B · 484 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 18 disulfide, 4 glycan, 2 modified (disulfide, N-glycosylation, cyclization).

Compared structures

  • 3OVW · Endoglucanase I native structure · the same entry in another collection · chain A against A, TM-score 1.00
  • P46237 · AlphaFold monomer V2.0 prediction for endoglucanase type C (P46237) · a predicted model of the same protein · chain A against A, TM-score 1.00

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