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MolNFT v2 · #179197 · protein

Crystal structure of tubulin in complex with Maytansinol

7E4Z: “Crystal structure of tubulin in complex with Maytansinol”. X-ray diffraction at 2.69, 7 ligands (GTP, GDP, BKL). MolNFT v2 #179197 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7E4Z
Type
protein
Length
2,197 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.69
Source
Bos taurus; Gallus gallus; Rattus norvegicus
UniProt
P81947, Q6B856, P63043, E1BQ43
Ligands
GTP, GDP, BKL, ACP, MG, CA, CL

Structure

x-ray diffraction · resolution 2.69 · 5 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C—protein440—P81947
B—protein425—Q6B856
D—protein421—Q6B856
E—protein123—P63043
F—protein348—E1BQ43

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · 3 copies · chains A, B, C, D
  • GDP · Guanosine-5'-diphosphate · ligand · chains B
  • BKL · (1R,2S,3S,5S,6S,16E,18E,20R,21S)-11-chloro-6,21-dihydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-4,24-dioxa-9,22-diazatetracyclo[19.3.1.1~10,14~.0~3, 5~]hexacosa-10(26),11,13,16,18-pentaene-8,23-dione · ligand · chains D
  • ACP · Phosphomethylphosphonic acid adenylate ester · ligand · chains F
  • MG · Magnesium ion · metal · 5 copies · chains A, B, C, D
  • CA · Calcium ion · metal · 4 copies · chains A, B, C, E
  • CL · Chloride ion · ion · chains A
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 3 copies · chains A, B, E

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

Compared structures

  • 7E4Z · Crystal structure of tubulin in complex with maytansinol · the same entry in another collection · chain C against C, TM-score 1.00
  • P81947 · AlphaFold monomer V2.0 prediction for tubulin alpha-1B chain (P81947) · a predicted model of the same protein · chain A against A, TM-score 0.94

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