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MolNFT v1 · #77692 · protein

Crystal structure of chorismate mutase from bartonella henselae str. houston-1 in complex with malate

3RMI · Chorismate mutase protein: “Crystal structure of chorismate mutase from bartonella henselae str. houston-1 in complex with malate”. X-ray diffraction, 1 ligand (MLT), 1 pocket (best druggability 0.44). MolNFT v1 #77692 on GenesisL1…

PDB
3RMI
Type
protein
Length
105 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chorismate mutase protein
EC
5.4.99.5
UniProt
Q6G5B4
Ligands
MLT
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 88% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChorismate mutase protein (EC 5.4.99.5)protein10588% helix, 0% strandQ6G5B4

Ligands and binding sites

  • MLT · D-malate · ligand · chains A
  • EDO · 1,2-ethanediol · additive · chains A
  • GOL · Glycerol · 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
1690.440.8213empty

Compared structures

  • 3RMI · Crystal structure of Chorismate mutase from Bartonella henselae str. Houston-1 in complex… · the same entry in another collection · chain A against A, TM-score 1.00

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