4Y96

Crystal structure of Triosephosphate Isomerase from Gemmata obscuriglobus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2014-11-13
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 65 2 2
Unit cell lengths	124.778, 124.778, 134.231
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.360 - 1.581
R-factor	0.1784
Rwork	0.177
R-free	0.20100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1b9b
RMSD bond length	0.006
RMSD bond angle	1.138
Data reduction software	CrystalClear
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.360	1.670
High resolution limit [Å]	1.580	1.580
Rmerge	0.040	0.487
Number of reflections	81335
<I/σ(I)>	29	4.8
Completeness [%]	99.3	99.3
Redundancy	9.6	9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	291.15	0.2 M potassium sodium tartrate, 0.1 M sodium citrate tribasic pH 5.6, 2 M ammonium sulfate