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MolNFT v1 · #162749 · protein

Dodecin from streptomyces davaonensis

6RI3: “Dodecin from streptomyces davaonensis”. X-ray diffraction, 3 pockets (best druggability 0.65). MolNFT v1 #162749 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6RI3
Type
protein
Length
408 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dodecin
UniProt
K4QXP8
Pockets
3 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 22% helix, 56% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, FDodecinprotein6822% helix, 56% strandK4QXP8

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12970.650.8131empty
24260.650.7840empty
33000.640.8034empty

Interfaces

8 interfaces between chains.

  • B–E · 603 Ų buried · 12 hydrogen bonds · protein-protein
  • C–D · 588 Ų buried · 11 hydrogen bonds · protein-protein
  • E–F · 578 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 556 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 528 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6RI3 · Dodecin from Streptomyces davaonensis · the same entry in another collection · chain A against A, TM-score 1.00

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