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MolNFT v1 · #127197 · protein

26S proteasome in presence of ATP (S1)

5MPD · 26S proteasome regulatory subunit RPN10: “26S proteasome in presence of ATP (S1)”. Electron microscopy, 20 pockets (best druggability 0.82). MolNFT v1 #127197 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MPD
Type
protein
Length
5,142 residues
Chains
13
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
26S proteasome regulatory subunit RPN10; Ubiquitin carboxyl-terminal hydrolase RPN11; 26S…
EC
3.4.19.12
UniProt
P38886, P43588, P32496, O13563, O94742, P38764, P32565, P40016, Q12250, Q12377, Q06103, Q08723, Q04062
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 13 distinct chains · 63% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
W26S proteasome regulatory subunit RPN10protein19732% helix, 19% strandP38886
VUbiquitin carboxyl-terminal hydrolase RPN11 (EC 3.4.19.12)protein28946% helix, 16% strandP43588
T26S proteasome regulatory subunit RPN12protein26671% helix, 1% strandP32496
X26S proteasome regulatory subunit RPN13protein1279% helix, 25% strandO13563
Y26S proteasome complex subunit SEM1protein5167% helix, 0% strandO94742
Z26S proteasome regulatory subunit RPN1protein90661% helix, 3% strandP38764
N26S proteasome regulatory subunit RPN2protein89064% helix, 4% strandP32565
S26S proteasome regulatory subunit RPN3protein47569% helix, 3% strandP40016
P26S proteasome regulatory subunit RPN5protein44074% helix, 2% strandQ12250
Q26S proteasome regulatory subunit RPN6protein43474% helix, 3% strandQ12377
R26S proteasome regulatory subunit RPN7protein38176% helix, 3% strandQ06103
U26S proteasome regulatory subunit RPN8protein29848% helix, 20% strandQ08723
O26S proteasome regulatory subunit RPN9protein38872% helix, 3% strandQ04062

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13480.820.9245empty
26430.810.8682empty
310070.810.8286empty
410880.810.8289empty
52310.770.9038empty

Interfaces

31 interfaces between chains.

  • V–U · 3996 Ų buried · 19 hydrogen bonds · protein-protein
  • T–S · 2062 Ų buried · 20 hydrogen bonds · protein-protein
  • Y–S · 1643 Ų buried · 22 hydrogen bonds · protein-protein
  • U–O · 1587 Ų buried · 4 hydrogen bonds · protein-protein
  • P–U · 1343 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 5MPD · 26S proteasome in presence of ATP (s1) · the same entry in another collection · chain R against R, TM-score 1.00

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