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mashulin

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[½»Á÷] ¡¾ÇóÖú¡¿Alert level A ÇóÖú ÒÑÓÐ3È˲ÎÓë

Alert level A
SHFSU01_ALERT_2_A The absolute value of parameter shift to su ratio > 0.20
Absolute value of the parameter shift to su ratio given 2.449
Additional refinement cycles may be required.
PLAT080_ALERT_2_A Maximum Shift/Error ............................ 2.45
PLAT220_ALERT_2_A Large Non-Solvent C Ueq(max)/Ueq(min) ... 5.21 Ratio
PLAT241_ALERT_2_A Check High Ueq as Compared to Neighbors for C13
PLAT242_ALERT_2_A Check Low Ueq as Compared to Neighbors for O4
PLAT242_ALERT_2_A Check Low Ueq as Compared to Neighbors for O5
PLAT242_ALERT_2_A Check Low Ueq as Compared to Neighbors for O6
PLAT242_ALERT_2_A Check Low Ueq as Compared to Neighbors for N13
PLAT242_ALERT_2_A Check Low Ueq as Compared to Neighbors for C22
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) ....... O10
PLAT306_ALERT_2_A Isolated Oxygen Atom (H-atoms Missing ?) ....... O12
PLAT412_ALERT_2_A Short Intra XH3 .. XHn H22A .. H69C .. 1.56 Ang.
PLAT430_ALERT_2_A Short Inter D...A Contact O11 .. O11" .. 2.00 Ang.
PLAT430_ALERT_2_A Short Inter D...A Contact O12 .. O13 .. 2.23 Ang.
PLAT601_ALERT_2_A Structure Contains Solvent Accessible VOIDS of . 466.00 A**3
PLAT093_ALERT_1_A No su¡¯s on H-atoms, but refinement reported as . mixed
PLAT234_ALERT_4_A Large Hirshfeld Difference N21 -- C24 .. 0.35 Ang.
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