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MolNFT v1 · #57081 · protein

Crystal structure of the complex between GP41 fragment N36 and fusion inhibitor C34/S138A

2ZZO · Transmembrane protein: “Crystal structure of the complex between GP41 fragment N36 and fusion inhibitor C34/S138A”. X-ray diffraction, 1 ligand (ACE). MolNFT v1 #57081 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2ZZO
Type
protein
Length
70 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transmembrane protein
UniProt
P04580, P04578
Ligands
ACE

Structure

x-ray diffraction · 2 distinct chains · 93% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
NTransmembrane proteinprotein3694% helix, 0% strandP04580
CTransmembrane proteinprotein3491% helix, 0% strandP04578

Ligands and binding sites

  • ACE · Acetyl group · ligand · 2 copies · chains N, C

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

Interfaces

1 interface between chains.

  • N–C · 763 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (covalent ligand).

Compared structures

  • 2ZZO · Crystal structure of the complex between GP41 fragment N36 and fusion inhibitor C34/S138A · the same entry in another collection · chain N against N, TM-score 1.00

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