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MolNFT v1 · #188144 · protein + DNA

Structure of FOXP3-DNA complex

7TDW · Forkhead box P3: “Structure of FOXP3-DNA complex”. X-ray diffraction, 4 pockets (best druggability 0.53). MolNFT v1 #188144 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7TDW
Type
protein + DNA
Length
118 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Forkhead box P3; DNA (5'-D(*AP*AP*AP*TP*TP*TP*GP*TP*TP*TP*AP*CP*TP*C)-3'); DNA…
UniProt
Q53Z59
Pockets
4 · best druggability 0.53

Structure

x-ray diffraction · 3 distinct chains · 43% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AForkhead box P3protein9043% helix, 12% strandQ53Z59
BDNA (5'-D(*AP*AP*AP*TP*TP*TP*GP*TP*TP*TP*AP*CP*TP*C)-3')dna14——
CDNA (5'-D(P*GP*AP*GP*TP*AP*AP*AP*CP*AP*AP*AP*TP*TP*T)-3')dna14——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1900.530.8420empty
2540.400.8114empty
3780.340.7615empty
4530.240.7317empty

Interfaces

3 interfaces between chains.

  • B–C · 614 Ų buried · 45 hydrogen bonds · nucleic-nucleic
  • A–C · 426 Ų buried · 8 hydrogen bonds · protein-nucleic
  • A–B · 407 Ų buried · 2 hydrogen bonds · protein-nucleic

Compared structures

  • 7TDW · Structure of FOXP3-DNA complex · the same entry in another collection · chain A against A, TM-score 1.00

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