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MolNFT v1 · #71541 · protein

Crystal structure of lprg mutant V91W from mycobacterium tuberculosis

3MH9 · Lipoprotein lprg: “Crystal structure of lprg mutant V91W from mycobacterium tuberculosis”. X-ray diffraction, 3 pockets (best druggability 0.80). MolNFT v1 #71541 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3MH9
Type
protein
Length
410 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lipoprotein lprg
UniProt
P0A5I8
Pockets
3 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 18% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CLipoprotein lprgprotein20518% helix, 48% strandP0A5I8
ALipoprotein lprgprotein20519% helix, 48% strandP0A5I8

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14210.800.8746empty
23940.780.8740empty
3790.530.8524empty

Interfaces

1 interface between chains.

  • C–A · 395 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 3MH9 · Crystal structure of LprG mutant V91W from Mycobacterium tuberculosis · the same entry in another collection · chain C against C, TM-score 1.00

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