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MolNFT v1 · #179068 · protein

C-type carbohydrate-recognition domain 4 of the mannose receptor complexed with methyl-mannoside

7JUD · Macrophage mannose receptor 1: “C-type carbohydrate-recognition domain 4 of the mannose receptor complexed with methyl-mannoside”. X-ray diffraction, 2 ligands (MMA, CA), 1 pocket (best druggability 0.64). MolNFT v1 #179068 on…

PDB
7JUD
Type
protein
Length
254 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Macrophage mannose receptor 1
UniProt
P22897
Ligands
MMA, CA
Pockets
1 · best druggability 0.64

Structure

x-ray diffraction · 2 distinct chains · 22% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMacrophage mannose receptor 1protein12224% helix, 28% strandP22897
BMacrophage mannose receptor 1protein13220% helix, 27% strandP22897

Ligands and binding sites

  • MMA · methyl alpha-D-mannopyranoside · sugar · 2 copies · chains A, B
  • CA · Calcium ion · metal · 3 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14390.640.7757empty

Interfaces

1 interface between chains.

  • A–B · 350 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 7JUD · C-type carbohydrate-recognition domain 4 of the mannose receptor complexed with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P22897 · AlphaFold monomer V2.0 prediction for macrophage mannose receptor 1 (P22897) · a predicted model of the same protein · chain A against A, TM-score 0.97

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