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[求助]
本人是新手，下面自己解的晶体A类错误不会改，求帮助。谢谢
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PLAT201_ALERT_2_A Isotropic non-H Atoms in Main Residue(s) ....... 50 Report PLAT213_ALERT_2_A Atom O41 has ADP max/min Ratio ..... 8.1 oblate And 2 other PLAT213 Alerts More ...PLAT222_ALERT_3_A Large Non-Solvent H Uiso(max)/Uiso(min) ... 10.0 Ratio PLAT222_ALERT_3_A Large Non-Solvent H Uiso(max)/Uiso(min) ... 10.0 Ratio PLAT234_ALERT_4_A Large Hirshfeld Difference C112 -- C114 .. 0.33 Ang. PLAT234_ALERT_4_A Large Hirshfeld Difference C136 -- C137 .. 0.44 Ang. PLAT242_ALERT_2_A Low 'MainMol' Ueq as Compared to Neighbors of C121 Check PLAT413_ALERT_2_A Short Inter XH3 .. XHn H11P .. H14I .. 1.46 Ang. PLAT601_ALERT_2_A Structure Contains Solvent Accessible VOIDS of . 222 Ang3 PLAT971_ALERT_2_A Check Calcd Residual Density 1.26A From Ti35 4.78 eA-3 PLAT971_ALERT_2_A Check Calcd Residual Density 1.01A From O24 4.48 eA-3 |
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