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MolNFT v1 · #125375 · protein

A protein structure

5L75 · Lipopolysaccharide ABC transporter, ATP-binding protein lptb: “A protein structure”. X-ray diffraction, 1 ligand (PT), 13 pockets (best druggability 0.75). MolNFT v1 #125375 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5L75
Type
protein
Length
1,135 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lipopolysaccharide ABC transporter, ATP-binding protein lptb; FIG000988: predicted…
UniProt
W1B6A5, W1B830, W1B8C5
Ligands
PT
Pockets
13 · best druggability 0.75

Structure

x-ray diffraction · 4 distinct chains · 43% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALipopolysaccharide ABC transporter, ATP-binding protein lptbprotein23534% helix, 19% strandW1B6A5
BLipopolysaccharide ABC transporter, ATP-binding protein lptbprotein23730% helix, 24% strandW1B6A5
FFIG000988: predicted permeaseprotein32351% helix, 7% strandW1B830
GFIG000906: predicted permeaseprotein34050% helix, 7% strandW1B8C5

Ligands and binding sites

  • PT · Platinum (II) ion · metal · 2 copies · chains A, G

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16400.750.8170empty
29080.730.7768empty
36240.710.7962empty
44760.670.7858empty
54580.650.7848empty

Interfaces

4 interfaces between chains.

  • F–G · 1812 Ų buried · 12 hydrogen bonds · protein-protein
  • B–F · 1016 Ų buried · 9 hydrogen bonds · protein-protein
  • A–G · 996 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 618 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5L75 · A protein structure · the same entry in another collection · chain A against A, TM-score 1.00

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