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MolNFT v1 · #119381 · protein

Crystal structure of the MEP2 mutant S453D from candida albicans

5FUF · Ammonium transporter: “Crystal structure of the MEP2 mutant S453D from candida albicans”. X-ray diffraction, 6 pockets (best druggability 0.64). MolNFT v1 #119381 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5FUF
Type
protein
Length
449 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ammonium transporter
UniProt
Q59UP8
Pockets
6 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 64% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAmmonium transporterprotein44964% helix, 3% strandQ59UP8

Ligands and binding sites

  • DMU · Decyl-beta-D-maltopyranoside · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13160.640.8049empty
2560.400.8113empty
3560.330.7815empty
4740.300.7317empty
5580.300.7513empty

Compared structures

  • 5FUF · Crystal structure of the Mep2 mutant S453D from Candida albicans · the same entry in another collection · chain A against A, TM-score 1.00

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