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MolNFT v1 · #115513 · protein + DNA

Crystal structure of kora, a plasmid-encoded, global transcription regulator

5CM3 · Trfb transcriptional repressor protein: “Crystal structure of kora, a plasmid-encoded, global transcription regulator”. X-ray diffraction, 3 pockets (best druggability 0.52). MolNFT v1 #115513 on GenesisL1: 3D structure, binding…

PDB
5CM3
Type
protein + DNA
Length
228 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Trfb transcriptional repressor protein; 5'-D(CP*CP*AP*AP*GP*TP*TP*TP*AP*GP*CP*TP*AP*AP*AP*…
UniProt
P03052
Pockets
3 · best druggability 0.52

Structure

x-ray diffraction · 3 distinct chains · 63% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATrfb transcriptional repressor proteinprotein9763% helix, 8% strandP03052
BTrfb transcriptional repressor proteinprotein9362% helix, 9% strandP03052
C, D5'-D(CP*CP*AP*AP*GP*TP*TP*TP*AP*GP*CP*TP*AP*AP*AP*CP*TP*TP* GP*GP*)-3'dna19——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12860.520.7532empty
21170.430.7719empty
31250.420.7620empty

Interfaces

6 interfaces between chains.

  • A–B · 1087 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 808 Ų buried · 73 hydrogen bonds · nucleic-nucleic
  • B–C · 486 Ų buried · 9 hydrogen bonds · protein-nucleic
  • A–D · 444 Ų buried · 11 hydrogen bonds · protein-nucleic
  • A–C · 379 Ų buried · 12 hydrogen bonds · protein-nucleic

Compared structures

  • 5CM3 · Crystal Structure of KorA, a plasmid-encoded, global transcription regulator · the same entry in another collection · chain A against A, TM-score 1.00
  • P03052 · AlphaFold monomer V2.0 prediction for trfb transcriptional repressor protein (P03052) · a predicted model of the same protein · chain A against A, TM-score 0.83

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