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MolNFT v1 · #155936 · protein

Cryo-EM structure of immature zika virus in complex with human antibody DV62.5 Fab

6LNT · Envelope protein: “Cryo-EM structure of immature zika virus in complex with human antibody DV62.5 Fab”. Electron microscopy, 7 pockets (best druggability 0.45). MolNFT v1 #155936 on GenesisL1: 3D structure, binding sites and pockets…

PDB
6LNT
Type
protein
Length
2,642 residues
Chains
12
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Envelope protein; Pre-membrane protein; Fab DV62.5 heavy-chain variable region; Fab…
EC
3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48
UniProt
A0A024B7W1
Pockets
7 · best druggability 0.45

Structure

electron microscopy · 5 distinct chains · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CEnvelope protein (EC 3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48)protein5030% helix, 0% strandA0A024B7W1
D, E, FPre-membrane protein (EC 3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48)protein1630% helix, 0% strandA0A024B7W1
H, PFab DV62.5 heavy-chain variable regionprotein1200% helix, 0% strand—
L, QFab DV62.5 light-chain variable regionprotein1060% helix, 0% strand—
M, NCapsid protein (EC 3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48)protein960% helix, 0% strandA0A024B7W1

Pockets

7 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11560.450.7337empty
2960.360.7231empty
3940.360.7230empty
4720.330.7329empty
5690.320.7320empty

Interfaces

9 interfaces between chains.

  • B–E · 550 Ų buried · 0 hydrogen bonds · protein-protein
  • M–N · 402 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 376 Ų buried · 0 hydrogen bonds · protein-protein
  • C–F · 374 Ų buried · 0 hydrogen bonds · protein-protein
  • A–H · 58 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6LNT · Cryo-EM structure of immature Zika virus in complex with human antibody DV62.5 Fab · the same entry in another collection · chain A against A, TM-score 1.00

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