7E5N

crystal structure of cis assembled TROP-2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2019-10-09
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97890
Spacegroup name	P 43 2 2
Unit cell lengths	145.144, 145.144, 217.716
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.947 - 3.200
R-factor	0.2432
Rwork	0.241
R-free	0.27580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4mzv
RMSD bond length	0.003
RMSD bond angle	0.807
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.16_3549: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.310
High resolution limit [Å]	3.200	3.200
Rmerge	0.193	0.851
Number of reflections	38952	38952
<I/σ(I)>	13.677
Completeness [%]	99.5
Redundancy	11.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		291	100 mM Tris base/ Hydrochloric acid pH 7.0, 200 mM Sodium chloride and 1000 mM Sodium citrate tribasic