STEREOSPECIFIC ASSIGNMENTS AND CHI-1 ROTAMERS FOR FKBP WHEN BOUND TO ASCOMYCIN FROM 3JH-ALPHA,H-BETA AND 3JN,H-BETA COUPLING-CONSTANTS

被引:27
作者
XU, RX [1 ]
OLEJNICZAK, ET [1 ]
FESIK, SW [1 ]
机构
[1] ABBOTT LABS,DIV PHARMACEUT DISCOVERY,D-47G,AP9,ABBOTT PK,IL 60064
关键词
FKBP; ASCOMYCIN; COUPLING CONSTANT; NMR;
D O I
10.1016/0014-5793(92)80881-G
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
3J(H-alpha,H-beta) and 3J(N,H-beta) coupling constants were measured for isotopically labeled FKBP when bound to the immunosuppressant, ascomycin, using a H-1-coupled 3D HCCH-TOCSY and N-15-coupled 3D HSQC-TOCSY experiment, respectively. From an analysis of these two sets of coupling constants, stereospecific beta-proton assignments and chi-1 rotamers for FKBP have been obtained. All of the chi-1 rotamers were consistent with the chi-1 angles measured in the X-ray crystal structure of the FKBP/FK506 complex, suggesting that the structures of the two complexes are similar.
引用
收藏
页码:137 / 143
页数:7
相关论文
共 26 条