GL1X · GenesisL1 explorer

MolNFT v1 · #15986 · protein

Fab fragment of a neutralizing antibody directed against an epitope of GP41 from HIV-1

1NLD · FAB1583: “Fab fragment of a neutralizing antibody directed against an epitope of GP41 from HIV-1”. X-ray diffraction, 6 pockets (best druggability 0.51). MolNFT v1 #15986 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1NLD
Type
protein
Length
434 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
FAB1583
Pockets
6 · best druggability 0.51

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LFAB1583protein2195% helix, 49% strand—
HFAB1583protein2155% helix, 48% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13120.510.7346empty
21180.470.7918empty
31010.420.7820empty
4840.340.7420empty
5780.300.7317empty

Interfaces

1 interface between chains.

  • L–H · 1788 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1NLD · Fab fragment of a neutralizing antibody directed against an epitope of GP41 from HIV-1 · the same entry in another collection · chain L against L, TM-score 1.00

Analyse

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