(Modeling proteins) (Chymotrypsin Mechanism: Step 1, Step 2, Step 3, Step 4, Step 5, Step 6)

Transition state between Steps 1 and 6 of Chymotrypsin Mechanism

  (PDB file) (ARC file)



In the transition state, the proton from Ser195 is between the amine of
Thr253 and His57; there is still a proton on Ser195, but this is from the
water molecule. The oxygen atom of the water molecule forms part of
the carboxylate on Trp252, and the second hydrogen of water is on
the amine nitrogen of Thr253.
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Interesting parts:
His57 Gly193 Asp194 Ser195 Trp252
Thr253 H2O

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  Step 1 Step 2 Step 3 Step 4 Step 5 Step 6
Step 1          
Step 2        
Step 3      
Step 4    
Step 5  
Step 6