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MolNFT v1 · #20660 · protein

Crystal structure of ybiv from escherichia COLI K12

1RLM · Phosphatase: “Crystal structure of ybiv from escherichia COLI K12”. X-ray diffraction, 1 ligand (MG), 9 pockets (best druggability 0.53). MolNFT v1 #20660 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1RLM
Type
protein
Length
1,076 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphatase
EC
3.1.3.-
UniProt
P75792
Ligands
MG
Pockets
9 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DPhosphatase (EC 3.1.3.-)protein26941% helix, 23% strandP75792

Ligands and binding sites

  • MG · Magnesium ion · metal · 4 copies · chains A, B, C, D
  • GOL · Glycerol · additive · 6 copies · chains A, B, C, D

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

Pockets

9 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11570.530.8124GOL
21490.520.8024GOL
31010.510.8322GOL
4830.460.8227GOL
5620.370.7916empty

Compared structures

  • 1RLM · Crystal Structure of ybiV from Escherichia coli K12 · the same entry in another collection · chain A against A, TM-score 1.00
  • P75792 · AlphaFold monomer V2.0 prediction for sugar phosphatase ybiv (P75792) · a predicted model of the same protein · chain A against A, TM-score 0.99

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