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MolNFT v1 · #122569 · protein

Crystal structure of mycobacterium avium SERB2 mutant D343N

5IT4 · Phosphoserine phosphatase: “Crystal structure of mycobacterium avium SERB2 mutant D343N”. X-ray diffraction, 1 ligand (MG), 1 pocket (best druggability 0.44). MolNFT v1 #122569 on GenesisL1: 3D structure, binding sites and pockets…

PDB
5IT4
Type
protein
Length
395 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoserine phosphatase
EC
3.1.3.3
UniProt
A0QJI1
Ligands
MG
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoserine phosphatase (EC 3.1.3.3)protein39540% helix, 28% strandA0QJI1

Ligands and binding sites

  • MG · Magnesium 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1850.440.8019empty

Compared structures

  • 5IT4 · Crystal structure of Mycobacterium avium SerB2 mutant D343N · the same entry in another collection · chain A against A, TM-score 1.00
  • A0QJI1 · AlphaFold monomer V2.0 prediction for phosphoserine phosphatase (A0QJI1) · a predicted model of the same protein · chain A against A, TM-score 1.00

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