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MolNFT v2 · #117509 · protein

Crystal structure of Mycobacterium tuberculosis L,D-transpeptidase 2 with carbapenem drug T210

5E1I: “Crystal structure of Mycobacterium tuberculosis L,D-transpeptidase 2 with carbapenem drug T210”. X-ray diffraction at 2.003, 2 ligands (6B8, NA). MolNFT v2 #117509 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5E1I
Type
protein
Length
701 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.003
Source
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
UniProt
I6Y9J2
Ligands
6B8, NA

Structure

x-ray diffraction · resolution 2.003 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein351—I6Y9J2
B—protein350—I6Y9J2

Ligands and binding sites

  • 6B8 · (2S,3R,4R)-2-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-3-methyl-4-(methylsulfanyl)-3,4-dihydro-2H-pyrrole-5-carboxylic acid · ligand · chains A
  • NA · Sodium ion · metal · chains A
  • GOL · Glycerol · additive · chains A

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

Compared structures

  • 5E1I · Crystal structure of mycobacterium tuberculosis L,D-transpeptidase 2 with carbapenem drug… · the same entry in another collection · chain A against A, TM-score 1.00
  • I6Y9J2 · AlphaFold monomer V2.0 prediction for L,D-transpeptidase 2 (I6Y9J2) · a predicted model of the same protein · chain A against A, TM-score 1.00

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