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MolNFT v1 · #82442 · protein

Crystal structure of tip-alpha N25 from helicobacter pylori in its natural dimeric form

3VNC: “Crystal structure of tip-alpha N25 from helicobacter pylori in its natural dimeric form”. X-ray diffraction, 3 pockets (best druggability 0.67). MolNFT v1 #82442 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3VNC
Type
protein
Length
295 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tip-alpha
UniProt
O25318
Pockets
3 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 51% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATip-alphaprotein14851% helix, 21% strandO25318
BTip-alphaprotein14750% helix, 21% strandO25318

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1810.670.9214empty
21560.410.7428empty
31250.380.7420empty

Interfaces

1 interface between chains.

  • A–B · 1070 Ų buried · 32 hydrogen bonds · protein-protein

Compared structures

  • 3VNC · Crystal Structure of TIP-alpha N25 from Helicobacter Pylori in its natural dimeric form · the same entry in another collection · chain A against A, TM-score 1.00

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