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Structure of human mitochondrial RNA polymerase in complex with imt inhibitor.

Analyse Structure of human mitochondrial RNA polymerase in complex with imt inhibitor. in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7A8P
Type
protein
Length
911 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase, mitochondrial
EC
2.7.7.6
UniProt
O00411
Ligands
R4Q
Pockets
11 · best druggability 0.84

Structure

electron microscopy · 1 distinct chain · 60% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-directed RNA polymerase, mitochondrial (EC 2.7.7.6)protein91160% helix, 7% strandO00411

Ligands and binding sites

  • R4Q · (3~{R})-1-[(2~{R})-2-[4-(2-chloranyl-4-fluoranyl-phenyl)-2-oxidanylidene-chromen-7-yl]oxypropanoyl]piperidine-3-carboxylic acid · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111440.840.8594R4Q
2600.680.9521empty
36340.680.7771empty
44040.580.7543empty
51870.560.8025empty

Compared structures

  • 7A8P · Structure of human mitochondrial RNA polymerase in complex with IMT inhibitor. · the same entry in another collection · chain A against A, TM-score 1.00
  • O00411 · AlphaFold monomer V2.0 prediction for DNA-directed RNA polymerase, mitochondrial (O00411) · a predicted model of the same protein · chain A against A, TM-score 0.94

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