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MolNFT v1 · #36493 · protein

Catm effector binding domain with its effector CIS,CIS-muconate

2F7C · Hth-type transcriptional regulator catm: “Catm effector binding domain with its effector CIS,CIS-muconate”. X-ray diffraction, 2 ligands (CCU, SO4), 2 pockets (best druggability 0.62). MolNFT v1 #36493 on GenesisL1: 3D structure…

PDB
2F7C
Type
protein
Length
216 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hth-type transcriptional regulator catm
UniProt
P07774
Ligands
CCU, SO4
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHth-type transcriptional regulator catmprotein21632% helix, 29% strandP07774

Ligands and binding sites

  • CCU · (2Z,4Z)-hexa-2,4-dienedioic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11210.620.8725CCU
2750.530.8518empty

Compared structures

  • 2F7C · CatM effector binding domain with its effector cis,cis-muconate · the same entry in another collection · chain A against A, TM-score 1.00
  • P07774 · AlphaFold monomer V2.0 prediction for hth-type transcriptional regulator catm (P07774) · a predicted model of the same protein · chain A against A, TM-score 0.97

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