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MolNFT v1 · #148440 · protein

Crystal structure of ebolavirus glycoprotein in complex with sertraline

6F6N: “Crystal structure of ebolavirus glycoprotein in complex with sertraline”. X-ray diffraction, 4 ligands (SRE, NAG, MAN). MolNFT v1 #148440 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6F6N
Type
protein
Length
384 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q05320, A0A0U3BWW0
Ligands
SRE, NAG, MAN, BMA

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein253—Q05320
B—protein131—A0A0U3BWW0

Ligands and binding sites

  • SRE · (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine · ligand · chains A, B
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B
  • MAN · alpha-D-mannopyranose · sugar · 2 copies
  • BMA · beta-D-mannopyranose · sugar
  • GOL · Glycerol · additive · 5 copies · chains A, B
  • DMS · Dimethyl sulfoxide · additive · chains A, B

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

Compared structures

  • 6F6N · Crystal structure of ebolavirus glycoprotein in complex with sertraline · the same entry in another collection · chain A against A, TM-score 1.00

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