4GLS

Crystal Structure of Chemically Synthesized Heterochiral {D-Protein Antagonist plus VEGF-A} Protein Complex in space group P21

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2010-12-09
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97916
Spacegroup name	P 1 21 1
Unit cell lengths	57.156, 88.322, 77.866
Unit cell angles	90.00, 99.98, 90.00

Refinement procedure

Resolution	34.604 - 1.600
R-factor	0.1922
Rwork	0.190
R-free	0.23130
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 3QTK 2qmt
RMSD bond length	0.006
RMSD bond angle	1.015
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: dev_1128))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.000	1.660
High resolution limit [Å]	1.600	1.600
Rmerge	0.046	0.365
Number of reflections	97962
<I/σ(I)>	17.8	1.77
Completeness [%]	97.8	96.2
Redundancy	2.1	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.4	292	Proteins were dissolved in 0.01 M HEPES, 50 mM NaCl at pH 8.4 and crystallized against reservoir containing 0.1 M MgCl2, 0.1 M HEPES, 12.5% PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 292K