GL1X · GenesisL1 explorer

MolNFT v1 · #156894 · protein

Cryo-EM structure of the zikv virion in complex with Fab fragments of the potently neutralizing human monoclonal antibody zikv-195

6MID · E protein: “Cryo-EM structure of the zikv virion in complex with Fab fragments of the potently neutralizing human…”. Electron microscopy, 1 ligand (NAG), 20 pockets (best druggability 0.87). MolNFT v1 #156894 on GenesisL1: 3D…

PDB
6MID
Type
protein
Length
1,965 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
E protein; M protein; Monoclonal antibody zikv-195 heavy chain; Monoclonal antibody…
UniProt
A0A024B7W1, A0A0B4J1U3
Ligands
NAG
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 4 distinct chains · 16% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, EE proteinprotein50118% helix, 33% strandA0A024B7W1
B, D, FM proteinprotein7548% helix, 0% strandA0A024B7W1
HMonoclonal antibody zikv-195 heavy chainprotein1272% helix, 31% strand—
LMonoclonal antibody zikv-195 light chainprotein1100% helix, 39% strandA0A0B4J1U3

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, E, C, L

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

Pockets

20 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15650.870.9365empty
211300.820.8488empty
311970.790.81117empty
411280.780.80103empty
57520.750.8066empty

Interfaces

14 interfaces between chains.

  • A–B · 1733 Ų buried · 20 hydrogen bonds · protein-protein
  • E–F · 1731 Ų buried · 16 hydrogen bonds · protein-protein
  • C–D · 1720 Ų buried · 21 hydrogen bonds · protein-protein
  • C–E · 1597 Ų buried · 11 hydrogen bonds · protein-protein
  • D–F · 1460 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 6MID · Cryo-EM structure of the ZIKV virion in complex with Fab fragments of the potently… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.