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MolNFT v2 · #206303 · protein

Structure of the disulfide-locked substrate binding protein HiSiaP.

8CP7 · Sialic acid-binding periplasmic protein SiaP: “Structure of the disulfide-locked substrate binding protein HiSiaP.”. X-ray diffraction at 1.9, 2 ligands (SLB, ZN), 1 pocket (best druggability 0.81). MolNFT v2 #206303 on GenesisL1…

PDB
8CP7
Type
protein
Length
310 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.9
Source
Haemophilus influenzae
Molecule
Sialic acid-binding periplasmic protein SiaP
UniProt
P44542
Ligands
SLB, ZN
Pockets
1 · best druggability 0.81

Structure

x-ray diffraction · resolution 1.9 · 1 distinct chain · 52% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASialic acid-binding periplasmic protein SiaPprotein31052% helix, 19% strandP44542

Ligands and binding sites

  • SLB · N-acetyl-beta-neuraminic acid · sugar · chains A
  • ZN · Zinc ion · metal · 2 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12190.810.9446SLB

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • P44542 · AlphaFold monomer V2.0 prediction for sialic acid-binding periplasmic protein siap… · a predicted model of the same protein · chain A against A, TM-score 0.98

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