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MolNFT v1 · #94164 · protein

The crystal structure of the zalpha domain from cyprinid herpes virus 3

4HOB · Putative uncharacterized protein: “The crystal structure of the zalpha domain from cyprinid herpes virus 3”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.70). MolNFT v1 #94164 on GenesisL1: 3D structure, binding…

PDB
4HOB
Type
protein
Length
252 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative uncharacterized protein
UniProt
A4FTK7
Ligands
SO4
Pockets
2 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 52% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative uncharacterized proteinprotein6253% helix, 11% strandA4FTK7
BPutative uncharacterized proteinprotein6352% helix, 11% strandA4FTK7
CPutative uncharacterized proteinprotein6749% helix, 10% strandA4FTK7
DPutative uncharacterized proteinprotein6055% helix, 12% strandA4FTK7

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 9 copies · chains A, C, D, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17050.700.7787SO4
21770.490.7631SO4

Interfaces

6 interfaces between chains.

  • A–B · 1483 Ų buried · 19 hydrogen bonds · protein-protein
  • C–D · 1245 Ų buried · 13 hydrogen bonds · protein-protein
  • B–D · 365 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 359 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 289 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 4HOB · The crystal structure of the Zalpha domain from Cyprinid Herpes virus 3 · the same entry in another collection · chain A against A, TM-score 1.00

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