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Crystal structure of NUP358/RANBP2 ran-binding domain 4 in complex with ran-gppnhp

Analyse Crystal structure of NUP358/RANBP2 ran-binding domain 4 in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7MNZ
Type
protein
Length
2,060 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GTP-binding nuclear protein ran; E3 sumo-protein ligase RANBP2
EC
2.3.2.-
UniProt
P62826, P49792
Ligands
GNP, MG
Pockets
20 · best druggability 0.78

Structure

x-ray diffraction · 4 distinct chains · 27% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, E, GGTP-binding nuclear protein ranprotein20630% helix, 24% strandP62826
B, D, F, H, J, LE3 sumo-protein ligase RANBP2 (EC 2.3.2.-)protein13812% helix, 45% strandP49792
C, KGTP-binding nuclear protein ranprotein20531% helix, 22% strandP62826
IGTP-binding nuclear protein ranprotein20431% helix, 24% strandP62826

Ligands and binding sites

  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · 6 copies · chains A, C, E, G, I, K
  • MG · Magnesium ion · metal · 6 copies · chains A, C, E, G, I, K

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

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18600.780.81103GNP, MG
210900.760.7992empty
39470.750.7886empty
45040.750.8357GNP, MG
54720.670.7848empty

Interfaces

33 interfaces between chains.

  • E–F · 2563 Ų buried · 27 hydrogen bonds · protein-protein
  • G–H · 2534 Ų buried · 32 hydrogen bonds · protein-protein
  • C–D · 2496 Ų buried · 35 hydrogen bonds · protein-protein
  • K–L · 2402 Ų buried · 34 hydrogen bonds · protein-protein
  • A–B · 2381 Ų buried · 33 hydrogen bonds · protein-protein

Compared structures

  • 7MNZ · Crystal Structure of Nup358/RanBP2 Ran-binding domain 4 in complex with Ran-GPPNHP · the same entry in another collection · chain G against G, TM-score 1.00

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