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MolNFT v2 · #51068 · protein

Crystal structure of Nasturtium xyloglucan hydrolase isoform NXG2

2UWC · Cellulase: “Crystal structure of Nasturtium xyloglucan hydrolase isoform NXG2”. X-ray diffraction at 2.3, 6 pockets (best druggability 0.56). MolNFT v2 #51068 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2UWC
Type
protein
Length
531 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.3
Source
TROPAEOLUM MAJUS
Molecule
Cellulase
EC
3.2.1.151, 3.2.1.4
UniProt
Q07524
Pockets
6 · best druggability 0.56

Structure

x-ray diffraction · resolution 2.3 · 2 distinct chains · 14% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACellulase (EC 3.2.1.151, 3.2.1.4)protein26615% helix, 41% strandQ07524
BCellulase (EC 3.2.1.151, 3.2.1.4)protein26514% helix, 42% strandQ07524

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1720.560.8820empty
22840.560.7641empty
3570.540.8820empty
42520.530.7640empty
5970.380.7515empty

Interfaces

1 interface between chains.

  • A–B · 615 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 2UWC · Crystal structure of nasturtium xyloglucan hydrolase isoform NXG2 · the same entry in another collection · chain A against A, TM-score 1.00

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