Alert level A
PLAT220_ALERT_2_A Large Non-Solvent C Ueq(max)/Ueq(min) ... 6.15 Ratio
PLAT222_ALERT_3_A Large Non-Solvent H Ueq(max)/Ueq(min) ... 9.90 Ratio
Alert level B
PLAT201_ALERT_2_B Isotropic non-H Atoms in Main Residue(s) ....... 1
PLAT230_ALERT_2_B Hirshfeld Test Diff for O21 -- C207 .. 12.58 su
PLAT230_ALERT_2_B Hirshfeld Test Diff for C201 -- C202 .. 13.02 su
Alert level C
SHFSU01_ALERT_2_C The absolute value of parameter shift to su ratio > 0.05
Absolute value of the parameter shift to su ratio given 0.073
Additional refinement cycles may be required.
PLAT080_ALERT_2_C Maximum Shift/Error ............................ 0.07
PLAT220_ALERT_2_C Large Non-Solvent O Ueq(max)/Ueq(min) ... 3.89 Ratio
PLAT230_ALERT_2_C Hirshfeld Test Diff for O21 -- C201 .. 5.81 su
PLAT230_ALERT_2_C Hirshfeld Test Diff for O22 -- C202 .. 6.43 su
PLAT230_ALERT_2_C Hirshfeld Test Diff for C205 -- C206 .. 6.06 su
PLAT230_ALERT_2_C Hirshfeld Test Diff for C313 -- C316 .. 5.60 su
PLAT230_ALERT_2_C Hirshfeld Test Diff for C318 -- C319 .. 5.58 su
PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for O21
PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C203
PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C202
PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C204
PLAT245_ALERT_2_C U(iso) H10A Smaller than U(eq) C107 by ... 0.01 AngSq
PLAT245_ALERT_2_C U(iso) H21A Smaller than U(eq) C217 by ... 0.03 AngSq
PLAT245_ALERT_2_C U(iso) H30E Smaller than U(eq) C308 by ... 0.02 AngSq
PLAT245_ALERT_2_C U(iso) H106 Smaller than U(eq) C106 by ... 0.02 AngSq
PLAT245_ALERT_2_C U(iso) H305 Smaller than U(eq) C305 by ... 0.02 AngSq
PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang .. 10
PLAT413_ALERT_2_C Short Inter XH3 .. XHn H11D .. H20D .. 2.14 Ang.
PLAT601_ALERT_2_C Structure Contains Solvent Accessible VOIDS of . 77.00 A**3
PLAT195_ALERT_1_C Missing _cell_measurement_theta_max datum .... ?
PLAT196_ALERT_1_C Missing _cell_measurement_theta_min datum .... ?
PLAT234_ALERT_4_C Large Hirshfeld Difference C110 -- C111 .. 0.16 Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C117 -- C118 .. 0.15 Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C204 -- C209 .. 0.20 Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C218 -- C219 .. 0.19 Ang.
PLAT234_ALERT_4_C Large Hirshfeld Difference C304 -- C309 .. 0.17 Ang.
PLAT731_ALERT_1_C Bond Calc 1.362(15), Rep 1.363(7) ...... 2.14 su-Ra
C201 -C206 1.555 1.555
PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1
C60 H69 La N6 O24
Alert level G
PLAT333_ALERT_2_G Check Large Av C6-Ring C-C Dist. C201 -C206 1.42 Ang.
PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 9
PLAT154_ALERT_1_G The su's on the Cell Angles are Equal (x 10000) 100 Deg.
2 ALERT level A = In general: serious problem 3 ALERT level B = Potentially serious problem 29 ALERT level C = Check and explain 3 ALERT level G = General alerts; check 4 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 24 ALERT type 2 Indicator that the structure model may be wrong or deficient 3 ALERT type 3 Indicator that the structure quality may be low 6 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check
