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MolNFT v2 · #152692 · protein

Yeast 20S proteasome with human beta2i (1-53) in complex with 18

6HVS: “Yeast 20S proteasome with human beta2i (1-53) in complex with 18”. X-ray diffraction at 3.1, 3 ligands (GRT, MG, CL). MolNFT v2 #152692 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6HVS
Type
protein
Length
6,341 residues
Chains
28
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.1
Source
Homo sapiens; Saccharomyces cerevisiae S288C
UniProt
P23639, P23638, P40303, P32379, P40302, P21242, P21243, P40306, P25043, P25451, P22141, P30656, P23724, P30657, P38624
Ligands
GRT, MG, CL

Structure

x-ray diffraction · resolution 3.1 · 15 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, O—protein250—P23639
B, P—protein244—P23638
C, Q—protein240—P40303
D, R—protein235—P32379
E, S—protein231—P40302
F, T—protein243—P21242
G, U—protein241—P21243
H—protein226—P40306, P25043
I, W—protein204—P25451
J, X—protein195—P22141
K, Y—protein212—P30656
L, Z—protein222—P23724
M, a—protein233—P30657
N, b—protein196—P38624
V—protein223—P40306, P25043

Ligands and binding sites

  • GRT · (2~{S})-~{N}-[2-[[(2~{S})-1-[4-(aminomethyl)phenyl]-4-methylsulfonyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]-2-[[(2~{S})-2-azido-3-phenyl-propanoyl]amino]-4-methyl-pentanamide · ligand · 4 copies · chains H, I, K, L, V, W, Y, Z
  • MG · Magnesium ion · metal · 8 copies · chains G, I, K, W, N, a, L, V, Y, H, Z
  • CL · Chloride ion · ion · 2 copies · chains G, H, U, V

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

Compared structures

  • 6HVS · Yeast 20S proteasome with human BETA2I (1-53) in complex with 18 · the same entry in another collection · chain B against B, TM-score 1.00

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