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MolNFT v1 · #36252 · protein

Epi-biotin complex with core streptavidin

2F01: “Epi-biotin complex with core streptavidin”. X-ray diffraction, 2 ligands (BTN, BTQ), 2 pockets (best druggability 0.48). MolNFT v1 #36252 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2F01
Type
protein
Length
241 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Streptavidin
UniProt
P22629
Ligands
BTN, BTQ
Pockets
2 · best druggability 0.48

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 56% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStreptavidinprotein1215% helix, 56% strandP22629
BStreptavidinprotein1205% helix, 56% strandP22629

Ligands and binding sites

  • BTN · Biotin · ligand · 2 copies · chains A, B
  • BTQ · Epi-biotin · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · 3 copies · chains A, 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1860.480.8117BTN, BTQ
2900.460.8019BTN, BTQ

Interfaces

1 interface between chains.

  • A–B · 1550 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 2F01 · Epi-biotin complex with core streptavidin · the same entry in another collection · chain A against A, TM-score 1.00

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