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MolNFT v1 · #155322 · protein

Crystal structure of metallo-beta-lactamase imp-27 from morganella morganii

6L3S · Imp-27 metallo-beta-lactamase: “Crystal structure of metallo-beta-lactamase imp-27 from morganella morganii”. X-ray diffraction, 1 ligand (ZN), 6 pockets (best druggability 0.44). MolNFT v1 #155322 on GenesisL1: 3D structure…

PDB
6L3S
Type
protein
Length
436 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Imp-27 metallo-beta-lactamase
UniProt
A0A286S0G7
Ligands
ZN
Pockets
6 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 28% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BImp-27 metallo-beta-lactamaseprotein21828% helix, 31% strandA0A286S0G7

Ligands and binding sites

  • ZN · Zinc ion · metal · 4 copies · chains A, B

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

Pockets

6 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11360.440.7632empty
21590.420.7425empty
31440.420.7524ZN
4790.420.7917empty
5760.390.7815empty

Interfaces

1 interface between chains.

  • A–B · 384 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6L3S · Crystal structure of metallo-beta-lactamase IMP-27 from Morganella morganii · the same entry in another collection · chain A against A, TM-score 1.00

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