Alert level C
PLAT213_ALERT_2_C Atom C24 has ADP max/min Ratio ..... 3.50 oblat
PLAT213_ALERT_2_C Atom C26 has ADP max/min Ratio ..... 3.30 oblat
PLAT213_ALERT_2_C Atom C27 has ADP max/min Ratio ..... 3.30 prola
PLAT213_ALERT_2_C Atom C125 has ADP max/min Ratio ..... 3.30 oblat
PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.35 Ratio
PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 4.00 Ratio
PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for O32
PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N31
PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for P103
PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang .. 15
PLAT234_ALERT_4_C Large Hirshfeld Difference C30 -- C31 .. 0.20 Ang.
Alert level G
REFLT03_ALERT_4_G Please check that the estimate of the number of Friedel pairs is
correct. If it is not, please give the correct count in the
_publ_section_exptl_refinement section of the submitted CIF.
From the CIF: _diffrn_reflns_theta_max 27.48
From the CIF: _reflns_number_total 11189
Count of symmetry unique reflns 6285
Completeness (_total/calc) 178.03%
TEST3: Check Friedels for noncentro structure
Estimate of Friedel pairs measured 4904
Fraction of Friedel pairs measured 0.780
Are heavy atom types Z>Si present yes
PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 59.99
PLAT301_ALERT_3_G Note: Main Residue Disorder ................... 20.00 Perc.
PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 492
PLAT063_ALERT_4_G Crystal Size Likely too Large for Beam Size .... 0.66 mm
PLAT811_ALERT_5_G No ADDSYM Analysis: Too Many Excluded Atoms .... !
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 11 ALERT level C = Check and explain 6 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 9 ALERT type 2 Indicator that the structure model may be wrong or deficient 4 ALERT type 3 Indicator that the structure quality may be low 3 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check
