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MolNFT v1 · #118666 · protein

Crystal structure of a crenomytilus grayanus lectin in complex with GB3 allyl

5F90 · GALNAC/GAL-specific lectin: “Crystal structure of a crenomytilus grayanus lectin in complex with GB3 allyl”. X-ray diffraction, 5 ligands (5VQ, LMR, GAL). MolNFT v1 #118666 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5F90
Type
protein
Length
299 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GALNAC/GAL-specific lectin
UniProt
H2FH31
Ligands
5VQ, LMR, GAL, GLA, BGC

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGALNAC/GAL-specific lectinprotein1506% helix, 43% strandH2FH31
BGALNAC/GAL-specific lectinprotein1496% helix, 44% strandH2FH31

Ligands and binding sites

  • 5VQ · 2-Propen-1-ol · ligand · 3 copies
  • LMR · (2S)-2-hydroxybutanedioic acid · ligand · chains A
  • GAL · beta-D-galactopyranose · sugar · 5 copies · chains A, B
  • GLA · alpha-D-galactopyranose · sugar · 5 copies · chains A, B
  • BGC · beta-D-glucopyranose · sugar · 3 copies

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

Interfaces

1 interface between chains.

  • A–B · 743 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 5F90 · Crystal structure of a Crenomytilus grayanus lectin in complex with Gb3 allyl · the same entry in another collection · chain A against A, TM-score 1.00

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