2Y56

Fragment growing induces conformational changes in acetylcholine- binding protein: A structural and thermodynamic analysis - (Compound 3)

Refinement Statistics

Experimental method:X-RAY DIFFRACTION (3.59 Å)

Cell axes218.930218.930218.930
Cell angles90.0090.0090.00
SpacegroupI 2 3
Resolution limits48.95 - 3.59
the highest resolution shell value3.780 - 3.590
R-factor0.1752
R-work0.17380
the highest resolution shell value0.197
R-free0.20250
the highest resolution shell value0.244
RMSD bond length0.010
RMSD bond angle1.010

Data Collection Statistics

Resolution limits16.05 - 3.59
the highest resolution shell value -
Number of reflections20509
Rmerge_l_obs0.140
the highest resolution shell value0.600
Completeness99.8
Redundancy5.41
the highest resolution shell value5
I/sigma(I)2.87

Crystallization Conditions

crystal IDmethodpHpH rangetemperatureunit
18.5

Crystallization Reagents

IDcrystal IDsolution IDreagent nameconcentrationdetails
Crystallization Reagents in Literatures*
IDcrystal IDsolutionreagent nameconcentration (unit)details
Annotated Information is extracted from Literature Info*