One-way allosteric communication between the two disulfide bonds in tissue factor

Tissue factor (TF) is a transmembrane glycoprotein that plays distinct roles in the initiation of extrinsic coagulation cascade and thrombosis. TF contains two disulfide bonds, one each in the N-terminal and C-terminal extracellular domains. The C-domain disulfide, Cys186-Cys209, has a −RHStaple con...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Hauptverfasser: Zhou, Beifei (VerfasserIn) , Hogg, Philip J. (VerfasserIn) , Gräter, Frauke (VerfasserIn)
Dokumenttyp: Article (Journal)
Sprache:Englisch
Veröffentlicht: 10 January 2017
In: Biophysical journal
Year: 2017, Jahrgang: 112, Heft: 1, Pages: 78-86
ISSN:1542-0086
DOI:10.1016/j.bpj.2016.12.003
Online-Zugang:Verlag, kostenfrei, Volltext: http://dx.doi.org/10.1016/j.bpj.2016.12.003
Verlag, kostenfrei, Volltext: http://www.sciencedirect.com/science/article/pii/S0006349516342771
Volltext
Verfasserangaben:Beifei Zhou, Philip J. Hogg, and Frauke Gräter

MARC

LEADER 00000caa a2200000 c 4500
001 1578303079
003 DE-627
005 20220814210719.0
007 cr uuu---uuuuu
008 180806s2017 xx |||||o 00| ||eng c
024 7 |a 10.1016/j.bpj.2016.12.003  |2 doi 
035 |a (DE-627)1578303079 
035 |a (DE-576)508303079 
035 |a (DE-599)BSZ508303079 
035 |a (OCoLC)1341016407 
040 |a DE-627  |b ger  |c DE-627  |e rda 
041 |a eng 
084 |a 33  |2 sdnb 
100 1 |a Zhou, Beifei  |e VerfasserIn  |0 (DE-588)1163974870  |0 (DE-627)1028369220  |0 (DE-576)508302145  |4 aut 
245 1 0 |a One-way allosteric communication between the two disulfide bonds in tissue factor  |c Beifei Zhou, Philip J. Hogg, and Frauke Gräter 
264 1 |c 10 January 2017 
300 |a 9 
336 |a Text  |b txt  |2 rdacontent 
337 |a Computermedien  |b c  |2 rdamedia 
338 |a Online-Ressource  |b cr  |2 rdacarrier 
500 |a Gesehen am 06.08.2018 
520 |a Tissue factor (TF) is a transmembrane glycoprotein that plays distinct roles in the initiation of extrinsic coagulation cascade and thrombosis. TF contains two disulfide bonds, one each in the N-terminal and C-terminal extracellular domains. The C-domain disulfide, Cys186-Cys209, has a −RHStaple configuration in crystal structures, suggesting that this disulfide carries high pre-stress. The redox state of this disulfide has been proposed to regulate TF encryption/decryption. Ablating the N-domain Cys49-Cys57 disulfide bond was found to increase the redox potential of the Cys186-Cys209 bond, implying an allosteric communication between the domains. Using molecular dynamics simulations, we observed that the Cys186-Cys209 disulfide bond retained the −RHStaple configuration, whereas the Cys49-Cys57 disulfide bond fluctuated widely. The Cys186-Cys209 bond featured the typical −RHStaple disulfide properties, such as a longer S-S bond length, larger C-S-S angles, and higher bonded prestress, in comparison to the Cys49-Cys57 bond. Force distribution analysis was used to sense the subtle structural changes upon ablating the disulfide bonds, and allowed us to identify a one-way allosteric communication mechanism from the N-terminal to the C-terminal domain. We propose a force propagation pathway using a shortest-pathway algorithm, which we suggest is a useful method for searching allosteric signal transduction pathways in proteins. As a possible explanation for the pathway being one-way, we identified a pronounced lower degree of conformational fluctuation, or effectively higher stiffness, in the N-terminal domain. Thus, the changes of the rigid domain (N-terminal domain) can induce mechanical force propagation to the soft domain (C-terminal domain), but not vice versa. 
700 1 |a Hogg, Philip J.  |e VerfasserIn  |0 (DE-588)1163975419  |0 (DE-627)1028370431  |0 (DE-576)508303125  |4 aut 
700 1 |a Gräter, Frauke  |e VerfasserIn  |0 (DE-588)130664871  |0 (DE-627)505296764  |0 (DE-576)298331314  |4 aut 
773 0 8 |i Enthalten in  |t Biophysical journal  |d Cambridge, Mass. : Cell Press, 1960  |g 112(2017), 1, Seite 78-86  |h Online-Ressource  |w (DE-627)270425357  |w (DE-600)1477214-0  |w (DE-576)091017602  |x 1542-0086  |7 nnas  |a One-way allosteric communication between the two disulfide bonds in tissue factor 
773 1 8 |g volume:112  |g year:2017  |g number:1  |g pages:78-86  |g extent:9  |a One-way allosteric communication between the two disulfide bonds in tissue factor 
856 4 0 |u http://dx.doi.org/10.1016/j.bpj.2016.12.003  |x Verlag  |x Resolving-System  |z kostenfrei  |3 Volltext 
856 4 0 |u http://www.sciencedirect.com/science/article/pii/S0006349516342771  |x Verlag  |z kostenfrei  |3 Volltext 
951 |a AR 
992 |a 20180806 
993 |a Article 
994 |a 2017 
998 |g 130664871  |a Gräter, Frauke  |m 130664871:Gräter, Frauke  |d 700000  |d 708000  |d 700000  |d 718000  |e 700000PG130664871  |e 708000PG130664871  |e 700000PG130664871  |e 718000PG130664871  |k 0/700000/  |k 1/700000/708000/  |k 0/700000/  |k 1/700000/718000/  |p 3  |y j 
998 |g 1163974870  |a Zhou, Beifei  |m 1163974870:Zhou, Beifei  |p 1  |x j 
999 |a KXP-PPN1578303079  |e 3020299101 
BIB |a Y 
SER |a journal 
JSO |a {"recId":"1578303079","relHost":[{"name":{"displayForm":["ed. by the Biophysical Society"]},"language":["eng"],"id":{"zdb":["1477214-0"],"eki":["270425357"],"issn":["1542-0086"]},"note":["Gesehen am 20.05.2020"],"origin":[{"dateIssuedKey":"1960","publisher":"Cell Press ; Soc. ; Rockefeller Univ. Press","dateIssuedDisp":"1960-","publisherPlace":"Cambridge, Mass. ; Bethesda, Md. ; New York, NY"}],"pubHistory":["1.1960/61 -"],"recId":"270425357","type":{"media":"Online-Ressource","bibl":"periodical"},"part":{"issue":"1","extent":"9","volume":"112","text":"112(2017), 1, Seite 78-86","pages":"78-86","year":"2017"},"title":[{"subtitle":"BJ","title":"Biophysical journal","title_sort":"Biophysical journal"}],"disp":"One-way allosteric communication between the two disulfide bonds in tissue factorBiophysical journal","physDesc":[{"extent":"Online-Ressource"}],"corporate":[{"display":"Biophysical Society","role":"isb"}],"titleAlt":[{"title":"BJ"}]}],"note":["Gesehen am 06.08.2018"],"origin":[{"dateIssuedKey":"2017","dateIssuedDisp":"10 January 2017"}],"person":[{"role":"aut","given":"Beifei","display":"Zhou, Beifei","family":"Zhou"},{"family":"Hogg","given":"Philip J.","display":"Hogg, Philip J.","role":"aut"},{"family":"Gräter","role":"aut","given":"Frauke","display":"Gräter, Frauke"}],"title":[{"title_sort":"One-way allosteric communication between the two disulfide bonds in tissue factor","title":"One-way allosteric communication between the two disulfide bonds in tissue factor"}],"id":{"eki":["1578303079"],"doi":["10.1016/j.bpj.2016.12.003"]},"physDesc":[{"extent":"9 S."}],"type":{"media":"Online-Ressource","bibl":"article-journal"},"name":{"displayForm":["Beifei Zhou, Philip J. Hogg, and Frauke Gräter"]},"language":["eng"]} 
SRT |a ZHOUBEIFEIONEWAYALLO1020