Evidence: homology, Homology to previously deposited PDB files 2WF6 and 5OK2. Furthermore, NMR spectroscopy was used to confirm the presence of the complex with tetrafluoroaluminate and glucose 6-phosphate.
Type
Name
Symmetry operation
Number
identity operation
1_555
x,y,z
1
Buried area
1150 Å2
ΔGint
-17 kcal/mol
Surface area
10250 Å2
Method
PISA
Unit cell
Length a, b, c (Å)
37.520, 54.280, 104.420
Angle α, β, γ (deg.)
90.00, 90.00, 90.00
Int Tables number
19
Space group name H-M
P212121
-
Components
-
Protein / Sugars , 2 types, 2 molecules A
#1: Protein
Beta-phosphoglucomutase / / Beta-PGM
Mass: 24264.646 Da / Num. of mol.: 1 / Mutation: D10N, K125R, Y206H Source method: isolated from a genetically manipulated source Source: (gene. exp.) Lactococcus lactis subsp. lactis Il1403 (lactic acid bacteria) Gene: pgmB, LL0429, L0001 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P71447, beta-phosphoglucomutase
Resolution: 1.02→35.33 Å / Cor.coef. Fo:Fc: 0.977 / Cor.coef. Fo:Fc free: 0.972 / SU B: 1.055 / SU ML: 0.023 / Cross valid method: THROUGHOUT / ESU R: 0.026 / ESU R Free: 0.027 / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.1747
5373
5 %
RANDOM
Rwork
0.15147
-
-
-
obs
0.15265
101274
97.6 %
-
Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å