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MolNFT v1 · #83629 · protein

Crystal structure of P23-45 GP39 (6-132) bound to thermus thermophilus RNA polymerase beta-flap domain

3WOF · DNA-directed RNA polymerase subunit beta: “Crystal structure of P23-45 GP39 (6-132) bound to thermus thermophilus RNA polymerase beta-flap domain”. X-ray diffraction, 20 pockets (best druggability 0.79). MolNFT v1 #83629 on…

PDB
3WOF
Type
protein
Length
2,761 residues
Chains
24
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-directed RNA polymerase subunit beta; Putative uncharacterized protein
EC
2.7.7.6
UniProt
Q8RQE9, A7XX65
Pockets
20 · best druggability 0.79

Structure

x-ray diffraction · 8 distinct chains · 9% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein12910% helix, 36% strandQ8RQE9
B, H, J, L, P, R, T, V, XPutative uncharacterized proteinprotein1028% helix, 43% strandA7XX65
D, F, NPutative uncharacterized proteinprotein1039% helix, 43% strandA7XX65
E, QDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein12710% helix, 39% strandQ8RQE9
G, I, O, S, WDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein1299% helix, 39% strandQ8RQE9
KDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein12811% helix, 38% strandQ8RQE9
MDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein1288% helix, 39% strandQ8RQE9
UDNA-directed RNA polymerase subunit beta (EC 2.7.7.6)protein12110% helix, 34% strandQ8RQE9

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19380.790.81112empty
211340.790.81122empty
37550.750.80104empty
45660.730.8158empty
55000.720.8168empty

Interfaces

68 interfaces between chains.

  • Q–R · 1252 Ų buried · 32 hydrogen bonds · protein-protein
  • E–F · 1216 Ų buried · 26 hydrogen bonds · protein-protein
  • U–V · 1194 Ų buried · 26 hydrogen bonds · protein-protein
  • C–D · 1166 Ų buried · 26 hydrogen bonds · protein-protein
  • O–P · 1159 Ų buried · 25 hydrogen bonds · protein-protein

Compared structures

  • 3WOF · Crystal structure of P23-45 gp39 (6-132) bound to Thermus thermophilus RNA polymerase… · the same entry in another collection · chain E against E, TM-score 1.00

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