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serprot.html
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<script type="text/javascript" src="jsmol/JSmol.min.js"></script>
<script type="text/javascript">
var Info = {
color: "#FFFFFF", // white background
height: 400,
width: "100%", // fill the JSMol box to its container's width
coverImage: "images/white.png",
deferApplet: true, // don't load until user clicks on JSMol box
deferUncover: true, // don't uncover until script fully executed
script: "script scripts/serprot1.txt",
use: "HTML5",
j2sPath: "jsmol/j2s",
serverURL: "http://chemapps.stolaf.edu/jmol/jsmol/php/jsmol.php",
disableInitialConsole: true,
debug: false,
};
// don't load any JSMol until the page itself has finished loading
$(document).ready(function(){
// prevent JSMol from taking entire page
Jmol.setDocument(0);
// create new JSMol instance with parameters defined in Info above
Jmol.getApplet("myJmol1", Info);
// reuse Info parameters for subsequent JSMol instances, changing
// only the script path
Info.script = "script scripts/serprot2.txt";
Jmol.getApplet("myJmol2", Info);
Info.script = "script scripts/serprot3.txt";
Jmol.getApplet("myJmol3", Info);
Info.script = "script scripts/serprot4.txt";
Jmol.getApplet("myJmol4", Info);
Info.script = "script scripts/serprot5.txt";
Jmol.getApplet("myJmol5", Info);
Info.script = "script scripts/serprot6.txt";
Jmol.getApplet("myJmol6", Info);
Info.script = "script scripts/serprot7.txt";
Jmol.getApplet("myJmol7", Info);
// put JSMol code into the correct containers (id=jsmolWindowN)
$("#jsmolWindow1").html(Jmol.getAppletHtml(myJmol1));
$("#jsmolWindow2").html(Jmol.getAppletHtml(myJmol2));
$("#jsmolWindow3").html(Jmol.getAppletHtml(myJmol3));
$("#jsmolWindow4").html(Jmol.getAppletHtml(myJmol4));
$("#jsmolWindow5").html(Jmol.getAppletHtml(myJmol5));
$("#jsmolWindow6").html(Jmol.getAppletHtml(myJmol6));
$("#jsmolWindow7").html(Jmol.getAppletHtml(myJmol7));
// give our JSMol containers breathing room above and below
$("#myJmol1_appletinfotablediv").css({
"margin-top": "10px",
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"margin-bottom": "10px",
"margin-left": "auto"
});
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"margin-top": "10px",
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$("#resetBtn1").click(reset1);
$("#resetBtn2").click(reset2);
$("#resetBtn3").click(reset3);
$("#resetBtn4").click(reset4);
$("#resetBtn5").click(reset5);
$("#resetBtn6").click(reset6);
$("#resetBtn7").click(reset7);
$("#spinBox1").click(spin1);
$("#spinBox2").click(spin2);
$("#spinBox3").click(spin3);
$("#spinBox4").click(spin4);
$("#spinBox5").click(spin5);
$("#spinBox6").click(spin6);
$("#spinBox7").click(spin7);
});
function reset1(event){
Jmol.script(myJmol1, "script scripts/serprot1.txt")
};
function reset2(event){
Jmol.script(myJmol2, "script scripts/serprot2.txt")
};
function reset3(event){
Jmol.script(myJmol3, "script scripts/serprot3.txt")
};
function reset4(event){
Jmol.script(myJmol4, "script scripts/serprot4.txt")
};
function reset5(event){
Jmol.script(myJmol5, "script scripts/serprot5.txt")
};
function reset6(event){
Jmol.script(myJmol6, "script scripts/serprot6.txt")
};
function reset7(event){
Jmol.script(myJmol7, "script scripts/serprot7.txt")
};
function spin1(event){
if (event.target.checked){
Jmol.script(myJmol1, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol1, "spin off")
};
};
function spin2(event){
if (event.target.checked){
Jmol.script(myJmol2, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol2, "spin off")
};
};
function spin3(event){
if (event.target.checked){
Jmol.script(myJmol3, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol3, "spin off")
};
};
function spin4(event){
if (event.target.checked){
Jmol.script(myJmol4, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol4, "spin off")
};
};
function spin5(event){
if (event.target.checked){
Jmol.script(myJmol5, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol5, "spin off")
};
};
function spin6(event){
if (event.target.checked){
Jmol.script(myJmol6, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol6, "spin off")
};
};
function spin7(event){
if (event.target.checked){
Jmol.script(myJmol7, "set spin x 10; set spin y 10; spin on")
} else {
Jmol.script(myJmol7, "spin off")
};
};
// turn off the JSMol alert that binary file loading is limited
Jmol._alertNoBinary = false;
</script>
<!-- Page Title: Serine Protease -->
<h2>Introduction</h2>
<p>
These scripts show some aspects of the mechanism of the serine protease
chymotrypsin (Based on 8gch.pdb, Harel et al. (1991) Biochemistry
<strong>30</strong>: 5217-5225 and 2tbs.pdb, Smalas et al. (1994) Proteins
<strong>20</strong>: 149-166)
</p>
<br>
<h2>Serine Protease 1</h2>
<p>
The catalytic triad is composed of <span style="color:red;">His57</span>,
<span style="color:blue;">Asp102</span> and <span style="color:lime;">
Ser195</span>.
</p>
<!-- JSMol Window Container -->
<div id="jsmolWindow1"></div>
<!-- UI Control Box -->
<div style="text-align: center;">
<!-- give the button a right margin for spacing -->
<button type="button" id="resetBtn1" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox1"> Spin On/Off
</div>
<br>
<h2>Serine Protease 2</h2>
<p>
Note how proton (<span style="color:gold;">YELLOW</span>) transfer is setup
by the arrangement of the triad.
</p>
<div id="jsmolWindow2"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn2" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox2"> Spin On/Off
</div>
<br>
<h2>Serine Protease 3</h2>
<p>
Here is a view of a <span style="color:magenta;">substrate analog</span>
bound in the active site and the residues in the protein that interact with
it.
</p>
<div id="jsmolWindow3"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn3" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox3"> Spin On/Off
</div>
<br>
<h2>Serine Protease 4</h2>
<p>
Substrate binding involves two interactions: (1) the specificity pocket,
which binds a <span style="color:lime;"><strong>Trp</strong></span>, and (2)
nonspecific binding of the poylpeptide chain via hydrogen bonds
(<span style="color:gold;">YELLOW</span>).
</p>
<div id="jsmolWindow4"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn4" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox4"> Spin On/Off
</div>
<br>
<h2>Serine Protease 5</h2>
<p>
Here we see the <span style="color:blue;">catalytic traid</span> poised to
attack the substrate.
</p>
<div id="jsmolWindow5"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn5" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox5"> Spin On/Off
</div>
<br>
<h2>Serine Protease 6</h2>
<p>
Here we see that the tetrahedral intermediate is stablized by hydrogen bonds
between the <span style="color:cyan;">oxygen</span> of the tetrahedral
intermediate and the peptide backbone of the <span style="color:orange;">
oxyanion hole</span>.
</p>
<div id="jsmolWindow6"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn6" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox6"> Spin On/Off
</div>
<br>
<h2>Serine Protease 7</h2>
<p>
In trypsin, the specificity pocket has a negatively charged Asp that binds
to the basic sidechains Lys or Arg. In this view an inhibitor, benzamidine,
is bound to the active site.
</p>
<div id="jsmolWindow7"></div>
<div style="text-align: center; margin-top: 10px;">
<button type="button" id="resetBtn7" style="margin-right: 10px;">Reset</button>
<input type="checkbox" id="spinBox7"> Spin On/Off
</div>