2z9k: Difference between revisions

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==Overview==

Five active metal-conjugated inhibitors (PMA, TDT, EPDTC, JMF1586 and, JMF1600) bound with the 3C-like protease of severe acute respiratory, syndrome (SARS)-associated coronavirus were analyzed crystallographically., The complex structures reveal two major inhibition modes: Hg(2+)-PMA is, coordinated to C(44), M(49) and Y(54) with a square planar geometry at the, S3 pocket, whereas each Zn(2+) of the four zinc-inhibitors is, tetrahedrally coordinated to the H(41)-C(145) catalytic dyad. For, anti-SARS drug design, this Zn(2+)-centered coordination pattern would, serve as a starting platform for inhibitor optimization.

Five active metal-conjugated inhibitors (PMA, TDT, EPDTC, JMF1586 and JMF1600) bound with the 3C-like protease of severe acute respiratory syndrome (SARS)-associated coronavirus were analyzed crystallographically. The complex structures reveal two major inhibition modes: Hg(2+)-PMA is coordinated to C(44), M(49) and Y(54) with a square planar geometry at the S3 pocket, whereas each Zn(2+) of the four zinc-inhibitors is tetrahedrally coordinated to the H(41)-C(145) catalytic dyad. For anti-SARS drug design, this Zn(2+)-centered coordination pattern would serve as a starting platform for inhibitor optimization.

==About this Structure==

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==Reference==

Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors., Lee CC, Kuo CJ, Hsu MF, Liang PH, Fang JM, Shie JJ, Wang AH, FEBS Lett. 2007 Nov 27;581(28):5454-~~5458~~. Epub 2007 Nov 5. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=17981158 17981158]

Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors., Lee CC, Kuo CJ, Hsu MF, Liang PH, Fang JM, Shie JJ, Wang AH, FEBS Lett. 2007 Nov 27;581(28):5454-8. Epub 2007 Nov 5. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=17981158 17981158]

[[Category: Sars coronavirus]]

[[Category: Single protein]]

[[Category: Lee, C.C.]]

[[Category: Lee, C C.]]

[[Category: Wang, A.H.]]

[[Category: Wang, A H.]]

[[Category: DMS]]

[[Category: DOZ]]

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[[Category: zinc-finger]]

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@@ Line 4: / Line 4: @@
 ==Overview==
-Five active metal-conjugated inhibitors (PMA, TDT, EPDTC, JMF1586 and, JMF1600) bound with the 3C-like protease of severe acute respiratory, syndrome (SARS)-associated coronavirus were analyzed crystallographically., The complex structures reveal two major inhibition modes: Hg(2+)-PMA is, coordinated to C(44), M(49) and Y(54) with a square planar geometry at the, S3 pocket, whereas each Zn(2+) of the four zinc-inhibitors is, tetrahedrally coordinated to the H(41)-C(145) catalytic dyad. For, anti-SARS drug design, this Zn(2+)-centered coordination pattern would, serve as a starting platform for inhibitor optimization.
+Five active metal-conjugated inhibitors (PMA, TDT, EPDTC, JMF1586 and JMF1600) bound with the 3C-like protease of severe acute respiratory syndrome (SARS)-associated coronavirus were analyzed crystallographically. The complex structures reveal two major inhibition modes: Hg(2+)-PMA is coordinated to C(44), M(49) and Y(54) with a square planar geometry at the S3 pocket, whereas each Zn(2+) of the four zinc-inhibitors is tetrahedrally coordinated to the H(41)-C(145) catalytic dyad. For anti-SARS drug design, this Zn(2+)-centered coordination pattern would serve as a starting platform for inhibitor optimization.
 ==About this Structure==
@@ Line 10: / Line 10: @@
 ==Reference==
-Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors., Lee CC, Kuo CJ, Hsu MF, Liang PH, Fang JM, Shie JJ, Wang AH, FEBS Lett. 2007 Nov 27;581(28):5454-5458. Epub 2007 Nov 5. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=17981158 17981158]
+Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors., Lee CC, Kuo CJ, Hsu MF, Liang PH, Fang JM, Shie JJ, Wang AH, FEBS Lett. 2007 Nov 27;581(28):5454-8. Epub 2007 Nov 5. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=17981158 17981158]
 [[Category: Sars coronavirus]]
 [[Category: Single protein]]
-[[Category: Lee, C.C.]]
+[[Category: Lee, C C.]]
-[[Category: Wang, A.H.]]
+[[Category: Wang, A H.]]
 [[Category: DMS]]
 [[Category: DOZ]]
@@ Line 40: / Line 40: @@
 [[Category: zinc-finger]]
-''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Wed Jan 23 11:29:15 2008''
+''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 19:00:55 2008''