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MolNFT v1 · #14920 · protein

Site specific mutant (H64A) of human carbonic anhydrase II at high resolution

1MOO: “Site specific mutant (H64A) of human carbonic anhydrase II at high resolution”. X-ray diffraction, 3 ligands (4MZ, ZN, HG), 1 pocket (best druggability 0.55). MolNFT v1 #14920 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
1MOO
Type
protein
Length
256 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Carbonic anhydrase II
EC
4.2.1.1
UniProt
P00918
Ligands
4MZ, ZN, HG
Pockets
1 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 14% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACarbonic anhydrase II (EC 4.2.1.1)protein25614% helix, 31% strandP00918

Ligands and binding sites

  • 4MZ · 4-methylimidazole · ligand · 2 copies · chains A
  • ZN · Zinc ion · metal · chains A
  • HG · Mercury (II) ion · metal · 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
11280.550.8224ZN

Compared structures

  • 1MOO · Site Specific Mutant (H64A) of Human Carbonic Anhydrase II at high resolution · the same entry in another collection · chain A against A, TM-score 1.00
  • P00918 · AlphaFold monomer V2.0 prediction for carbonic anhydrase 2 (P00918) · a predicted model of the same protein · chain A against A, TM-score 1.00

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