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MolNFT v1 · #173503 · protein

Crystal structure of plastidial ribulose epimerase RPE1 from the model alga chlamydomonas reinhardtii

7B1W · Ribulose-phosphate 3-epimerase: “Crystal structure of plastidial ribulose epimerase RPE1 from the model alga chlamydomonas reinhardtii”. X-ray diffraction, 1 ligand (ZN), 20 pockets (best druggability 0.83). MolNFT v1 #173503 on…

PDB
7B1W
Type
protein
Length
2,760 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribulose-phosphate 3-epimerase
EC
5.1.3.1
UniProt
A8IKW6
Ligands
ZN
Pockets
20 · best druggability 0.83

Structure

x-ray diffraction · 4 distinct chains · 38% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
J, B, C, E, LRibulose-phosphate 3-epimerase (EC 5.1.3.1)protein22939% helix, 21% strandA8IKW6
A, G, H, I, KRibulose-phosphate 3-epimerase (EC 5.1.3.1)protein23039% helix, 20% strandA8IKW6
DRibulose-phosphate 3-epimerase (EC 5.1.3.1)protein23137% helix, 20% strandA8IKW6
FRibulose-phosphate 3-epimerase (EC 5.1.3.1)protein23437% helix, 20% strandA8IKW6

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains J, A, B, C, D, E, F, G, H, I, K, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12720.830.9542empty
26620.730.8058empty
36590.710.7862empty
45070.660.7746empty
54590.620.7655empty

Interfaces

18 interfaces between chains.

  • A–B · 1075 Ų buried · 12 hydrogen bonds · protein-protein
  • J–E · 1060 Ų buried · 14 hydrogen bonds · protein-protein
  • D–G · 1043 Ų buried · 12 hydrogen bonds · protein-protein
  • I–L · 686 Ų buried · 9 hydrogen bonds · protein-protein
  • C–K · 673 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 7B1W · Crystal structure of plastidial ribulose epimerase RPE1 from the model alga Chlamydomonas… · the same entry in another collection · chain J against J, TM-score 1.00

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