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Crystal structure of the DNA binding domain of human transcription factor FLI1 in complex with a 10-mer DNA accggaagtg

Analyse Crystal structure of the DNA binding domain of human transcription factor FLI1… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5E8I
Type
protein + DNA
Length
452 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Friend leukemia integration 1 transcription factor; DNA…
UniProt
Q01543
Ligands
CA
Pockets
7 · best druggability 0.71

Structure

x-ray diffraction · 3 distinct chains · 53% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, G, JFriend leukemia integration 1 transcription factorprotein9353% helix, 15% strandQ01543
B, E, H, KDNA (5'-D(*AP*CP*CP*GP*GP*AP*AP*GP*TP*G)-3')dna10——
C, F, I, LDNA (5'-D(*CP*AP*CP*TP*TP*CP*CP*GP*GP*T)-3')dna10——

Ligands and binding sites

  • CA · Calcium ion · metal · 8 copies · chains B, C, F, H, I, L

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19590.710.7673empty
21030.400.7713empty
3800.380.7812empty
4580.360.7913empty
51250.360.7321empty

Interfaces

19 interfaces between chains.

  • A–G · 884 Ų buried · 10 hydrogen bonds · protein-protein
  • D–J · 881 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 557 Ų buried · 9 hydrogen bonds · protein-nucleic
  • G–I · 552 Ų buried · 9 hydrogen bonds · protein-nucleic
  • J–L · 534 Ų buried · 11 hydrogen bonds · protein-nucleic

Compared structures

  • 5E8I · Crystal structure of the DNA binding domain of human transcription factor FLI1 in complex… · the same entry in another collection · chain L against L, TM-score 1.00

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