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MolNFT v1 · #109272 · protein

Crystal structure of the E396D SNP variant of the myocilin olfactomedin domain

4WXS: “Crystal structure of the E396D SNP variant of the myocilin olfactomedin domain”. X-ray diffraction, 2 ligands (CA, NA), 1 pocket (best druggability 0.40). MolNFT v1 #109272 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4WXS
Type
protein
Length
259 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myocilin
UniProt
Q99972
Ligands
CA, NA
Pockets
1 · best druggability 0.40

Structure

x-ray diffraction · 1 distinct chain · 5% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyocilinprotein2595% helix, 54% strandQ99972

Ligands and binding sites

  • CA · Calcium ion · metal · chains A
  • NA · Sodium ion · metal · chains A
  • GOL · Glycerol · additive · 3 copies · chains A
  • PG4 · Tetraethylene glycol · additive · chains A
  • P6G · Hexaethylene glycol · additive · 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
1810.400.7819empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 4WXS · Crystal Structure of the E396D SNP Variant of the Myocilin Olfactomedin Domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q99972 · AlphaFold monomer V2.0 prediction for myocilin (Q99972) · a predicted model of the same protein · chain A against A, TM-score 0.98

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