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MolNFT v1 · #71473 · protein

Crystal structure of the S-type pyocin domain of ECA1669 protein from erwinia carotovora, northeast structural genomics consortium target EWR82C

3MFB · Uncharacterized protein: “Crystal structure of the S-type pyocin domain of ECA1669 protein from erwinia carotovora, northeast…”. X-ray diffraction, 4 pockets (best druggability 0.70). MolNFT v1 #71473 on GenesisL1: 3D structure…

PDB
3MFB
Type
protein
Length
600 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
Q6D6L3
Pockets
4 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DUncharacterized proteinprotein15010% helix, 36% strandQ6D6L3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18760.700.7575empty
22960.590.7842empty
31220.420.7620empty
4570.260.7313empty

Interfaces

4 interfaces between chains.

  • B–C · 436 Ų buried · 4 hydrogen bonds · protein-protein
  • A–D · 431 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 406 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 11 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 20 modified (engineered).

Compared structures

  • 3MFB · Crystal Structure of the S-type Pyocin domain of ECA1669 protein from Erwinia carotovora… · the same entry in another collection · chain A against A, TM-score 1.00

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