Alert level A
PLAT432_ALERT_2_A Short Inter X...Y Contact C111 .. C111 .. 2.71 Ang.
Alert level B
DIFMN02_ALERT_2_B The minimum difference density is < -0.1*ZMAX*1.00
_refine_diff_density_min given = -0.886
Test value = -0.800
RFACR01_ALERT_3_B The value of the weighted R factor is > 0.35
Weighted R factor given 0.373
PLAT084_ALERT_2_B High R2 Value .................................. 0.37
PLAT098_ALERT_2_B Minimum (Negative) Residual Density ............ -0.89 e/A**
Alert level C
DIFMN03_ALERT_1_C The minimum difference density is < -0.1*ZMAX*0.75
The relevant atom site should be identified.
DIFMX01_ALERT_2_C The maximum difference density is > 0.1*ZMAX*0.75
_refine_diff_density_max given = 0.780
Test value = 0.600
DIFMX02_ALERT_1_C The maximum difference density is > 0.1*ZMAX*0.75
The relevant atom site should be identified.
RFACG01_ALERT_3_C The value of the R factor is > 0.10
R factor given 0.125
PLAT082_ALERT_2_C High R1 Value .................................. 0.13
PLAT097_ALERT_2_C Maximum (Positive) Residual Density ............ 0.78 e/A**
PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 2.85 Ratio
PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 3.31 Ratio
PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.11
PLAT301_ALERT_3_C Main Residue Disorder ......................... 3.00 Perc.
PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang ... 7
PLAT066_ALERT_1_C Predicted and Reported Transmissions Identical . ?
PLAT154_ALERT_1_C The su's on the Cell Angles are Equal (x 10000) 200 Deg.
PLAT779_ALERT_4_C Suspect or Irrelevant (Bond) Angle in CIF ...... 9.00 Deg.
C110 -O5 -C10 1.555 1.555 1.555
Alert level G
PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 2
PLAT793_ALERT_4_G Check the Absolute Configuration of C3 ..... R
PLAT793_ALERT_4_G Check the Absolute Configuration of C4 ..... S
PLAT793_ALERT_4_G Check the Absolute Configuration of C5 ..... R
PLAT793_ALERT_4_G Check the Absolute Configuration of C8 ..... S
PLAT793_ALERT_4_G Check the Absolute Configuration of C33 ..... R
PLAT793_ALERT_4_G Check the Absolute Configuration of C34 ..... S
PLAT793_ALERT_4_G Check the Absolute Configuration of C35 ..... R
PLAT793_ALERT_4_G Check the Absolute Configuration of C38 ..... S
1 ALERT level A = In general: serious problem 4 ALERT level B = Potentially serious problem 14 ALERT level C = Check and explain 9 ALERT level G = General alerts; check 4 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 6 ALERT type 3 Indicator that the structure quality may be low 9 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check
