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MolNFT v1 · #152314 · protein

Crystal structure of vibrio cholerae mate transporter vcmn D35N mutant

6IDS · Mate family efflux transporter: “Crystal structure of vibrio cholerae mate transporter vcmn D35N mutant”. X-ray diffraction, 4 pockets (best druggability 0.84). MolNFT v1 #152314 on GenesisL1: 3D structure, binding sites and pockets…

PDB
6IDS
Type
protein
Length
438 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mate family efflux transporter
UniProt
A0A2A1YWE9
Pockets
4 · best druggability 0.84

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AMate family efflux transporterprotein43888% helix, 0% strandA0A2A1YWE9

Ligands and binding sites

  • OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111310.840.8472OLC
21130.390.7522empty
3560.320.7618empty
4580.290.7419OLC

Compared structures

  • 6IDS · Crystal structure of Vibrio cholerae MATE transporter VcmN D35N mutant · the same entry in another collection · chain A against A, TM-score 1.00

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