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MolNFT v1 · #141092 · protein

Crystal structure of unlinked full length NS3 protein (ED4NS2BNS3) from DENV4 in closed conformation

5YVY · Genome polyprotein: “Crystal structure of unlinked full length NS3 protein (ED4NS2BNS3) from DENV4 in closed conformation”. X-ray diffraction, 7 pockets (best druggability 0.81). MolNFT v1 #141092 on GenesisL1: 3D structure, binding…

PDB
5YVY
Type
protein
Length
618 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Genome polyprotein
UniProt
F8J1V3, F8TEL4
Pockets
7 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 23% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGenome polyproteinprotein360% helix, 17% strandF8J1V3
BGenome polyproteinprotein58224% helix, 22% strandF8TEL4

Pockets

7 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111690.810.8286empty
25120.700.8050empty
31090.550.8430empty
41640.550.8045empty
5510.500.8817empty

Interfaces

1 interface between chains.

  • A–B · 1312 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 5YVY · Crystal structure of unlinked full length NS3 protein (eD4NS2BNS3) from DENV4 in closed… · the same entry in another collection · chain A against A, TM-score 1.00

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