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DNA binding domain of early B-cell factor 1 (EBF1) bound to DNA (crystal form II)

Analyse DNA binding domain of early B-cell factor 1 (EBF1) bound to DNA (crystal form… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MLN
Type
protein + DNA
Length
627 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcription factor COE1; DNA (5'- D(*CP*TP*TP*TP*AP*TP*TP*CP*CP*CP*AP*TP*GP*GP*GP*AP*AP*…
UniProt
Q07802
Ligands
ZN
Pockets
6 · best druggability 0.88

Structure

x-ray diffraction · 4 distinct chains · 11% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscription factor COE1protein20614% helix, 40% strandQ07802
BTranscription factor COE1protein21314% helix, 38% strandQ07802
ETranscription factor COE1protein1645% helix, 52% strandQ07802
C, DDNA (5'- D(*CP*TP*TP*TP*AP*TP*TP*CP*CP*CP*AP*TP*GP*GP*GP*AP*AP*TP*AP*AP*AP*G)- 3')dna22——

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19580.880.8998empty
2530.500.8712empty
3950.350.7515empty
4920.350.7516empty
5670.320.7612empty

Interfaces

9 interfaces between chains.

  • C–D · 963 Ų buried · 95 hydrogen bonds · nucleic-nucleic
  • B–C · 736 Ų buried · 15 hydrogen bonds · protein-nucleic
  • B–E · 726 Ų buried · 14 hydrogen bonds · protein-protein
  • A–D · 721 Ų buried · 17 hydrogen bonds · protein-nucleic
  • A–C · 720 Ų buried · 19 hydrogen bonds · protein-nucleic

Compared structures

  • 3MLN · DNA binding domain of Early B-cell Factor 1 (Ebf1) bound to DNA (crystal form II) · the same entry in another collection · chain D against D, TM-score 1.00
  • Q07802 · AlphaFold monomer V2.0 prediction for transcription factor COE1 (Q07802) · a predicted model of the same protein · chain A against A, TM-score 0.99

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