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MolNFT v1 · #189901 · protein

Plant receptor like protein RXEG1 in complex with xyloglucanase XEG1

7W3V · Cell 12A endoglucanase: “Plant receptor like protein RXEG1 in complex with xyloglucanase XEG1”. Electron microscopy, 3 ligands (NAG, MAN, BMA), 8 pockets (best druggability 0.72). MolNFT v1 #189901 on GenesisL1: 3D structure…

PDB
7W3V
Type
protein
Length
918 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cell 12A endoglucanase; Membrane-localized lrr receptor-like protein
UniProt
Q30BZ2, A0A2I8B6R1
Ligands
NAG, MAN, BMA
Pockets
8 · best druggability 0.72

Structure

electron microscopy · 2 distinct chains · 12% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACell 12A endoglucanaseprotein2227% helix, 52% strandQ30BZ2
CMembrane-localized lrr receptor-like proteinprotein69614% helix, 21% strandA0A2I8B6R1

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 18 copies · chains C, A
  • MAN · alpha-D-mannopyranose · sugar · 5 copies · chains A, C
  • BMA · beta-D-mannopyranose · sugar

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13890.720.8338empty
22490.720.8747empty
36850.660.7582MAN
43040.540.7445NAG
51150.430.7821empty

Interfaces

1 interface between chains.

  • A–C · 2014 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 13 glycan, 3 disulfide (N-glycosylation, disulfide).

Compared structures

  • 7W3V · Plant receptor like protein RXEG1 in complex with xyloglucanase XEG1 · the same entry in another collection · chain A against A, TM-score 1.00

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