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MolNFT v1 · #134284 · protein

Structure of human RAB1B in complex with the bmerb domain of mical-cl

5SZH · Mical C-terminal-like protein: “Structure of human RAB1B in complex with the bmerb domain of mical-cl”. X-ray diffraction, 2 ligands (GNP, MG), 2 pockets (best druggability 0.79). MolNFT v1 #134284 on GenesisL1: 3D structure…

PDB
5SZH
Type
protein
Length
318 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mical C-terminal-like protein; RAS-related protein rab-1B
UniProt
Q6ZW33, Q9H0U4
Ligands
GNP, MG
Pockets
2 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 61% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMical C-terminal-like proteinprotein14392% helix, 0% strandQ6ZW33
BRAS-related protein rab-1Bprotein17535% helix, 26% strandQ9H0U4

Ligands and binding sites

  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · chains B
  • MG · Magnesium ion · metal · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18350.790.8276GNP, MG
2530.280.7413empty

Interfaces

1 interface between chains.

  • A–B · 1205 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5SZH · Structure of human Rab1b in complex with the bMERB domain of Mical-cL · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9H0U4 · AlphaFold monomer V2.0 prediction for RAS-related protein rab-1B (Q9H0U4) · a predicted model of the same protein · chain B against A, TM-score 0.97

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