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1INTRODUCTIONRecently,considerableattentionhasbeenpaidtotheinvestigationofcoordinationchemistryofmanganeseindifferentoxidationstatesnotonlybecauseofthediscoveryoftightlyboundmanganeseatomsinvariousbiomolecules[libutalsobecauseoftheirinterestingstructural,magneticandspectroscopicfeatures.Wehavepreparedseveralcomplexesofmanganese(n)withdifferentligands.Thestructuresandfeaturesofthesecompoundsarestudiedsystematically.Inthispaperwedescribethestructureofthecomplexwiththeligandsofphenanthroline… 相似文献
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在酸性条件下(pH=5.4)培养出正交晶系天花粉蛋白晶体。用面探测器收集了X射线衍射强度数据。以C2空间群天花粉蛋白2.6分辨率的晶体结构中的分子模型作为已知结构模型,用分子置换法解出正交晶系P2_12_12_1空间群天花粉蛋白的晶体结构。所得到的初始结构模型先后用模拟退火法和立体化学制约的最小二乘修正技术对原子坐标及温度因子进行修正。最后在2.4分辨率范围内模型的β因子为0.197,键长的均方根误差为0.021,键角距离的均方根误差为0.081。分子结构模型与(2Fo—Fc)为系数的电子云密度图吻合得很好。键长键角合理。结构测定结果表明,P2_12_12_1;空间群天花粉蛋白的分子的空间结构与单斜晶系C2空间群中的分子结构甚为相似。 相似文献
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The crystallographic refinement of trichosanthin has been performed at 2.6 resolution. The crystal and molecular structure of trichosanthin is described in detail in this paper. On summarizing the regularity of the amino acid sequences of eight kinds of ribosome inactivating proteins and combining with the crystal and molecular structure of trichosanthin, fifteen most conservative amino acid residues are analyzed. It is found that four most conservative polar amino acid residues Gln156, Glu160, Arg163 and Glu189 gather on the molecular surface on the boundary of the large and small domains, thus forming the active center of the protein molecule. 相似文献
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VOSO_4与α-羟基乙酸在水溶液中进行反应,用KOH调节到适当的pH值,制得兰绿色的晶体化合物.晶体属单斜晶系,空间群为P2_1/b.在CAD4 四圆衍射仪上用MoKa射线收集到1714个I≥3σ(I)的独立衍射点.结构用直接法和Patte-rson法结合解出,经全矩阵最小二乘法修正,R=0.060.络合物的中心原子钒与配位体分子的比例为M:L=1:3.三个与钒配位的a-羟基乙酸中,两个是双齿螯合,并互为邻位排布,另一个则是单端络合,形成一种较为独特的配位化合物。 相似文献
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A model completed recently of two trichosanthin molecules in an asymmetric unit belonging to themonoclinic system is reported. It can be seen that the molecular, structure consists of two domains, onelarge and one small, and that there are some features in the secondary structure. The dissimilarity be-tween two molecules as well as their interactions in an independent unit rorrelated in a non-symmetricway has been described. moreover, the binding sites of the heavyatom position in the derivatives are alsodiscussed. 相似文献