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MolNFT v1 · #44880 · protein

Solution structure of ALGE6R3 subunit from the azotobacter vinelandii mannuronan C5-epimerase

2ML3 · POLY(BETA-D-mannuronate) C5 epimerase 6: “Solution structure of ALGE6R3 subunit from the azotobacter vinelandii mannuronan C5-epimerase”. Solution nmr, 1 ligand (CA), 1 pocket (best druggability 0.27). MolNFT v1 #44880 on GenesisL1…

PDB
2ML3
Type
protein
Length
181 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
POLY(BETA-D-mannuronate) C5 epimerase 6
EC
5.1.3.-
UniProt
Q9ZFH0
Ligands
CA
Pockets
1 · best druggability 0.27

Structure

solution nmr · 1 distinct chain · 2% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APOLY(BETA-D-mannuronate) C5 epimerase 6 (EC 5.1.3.-)protein1812% helix, 25% strandQ9ZFH0

Ligands and binding sites

  • CA · Calcium ion · metal · 6 copies · 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.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1570.270.7315empty

Compared structures

  • 2ML3 · Solution Structure of AlgE6R3 subunit from the Azotobacter vinelandii Mannuronan… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9ZFH0 · AlphaFold monomer V2.0 prediction for mannuronan C5-epimerase ALGE6 (Q9ZFH0) · a predicted model of the same protein · chain A against A, TM-score 0.72

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