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Full-length gp120 peptides are not readily available.  Check the manufacturing details to ensure that the epitope is included in the peptide.  Also check that peptide comes glycosylated.


HXB2 strain:

Abcam:  10ug/$228

MyBioSource:  50ug/$365

**PROBLEM:  These have the amino acid sequence RKRIRIQRGPGRAFVTIG

Sequence data:  NCBI, UniProt

Serine residue does contribute to binding:  0.5beta binding interactions.pdf

 

Tried testing binding in silico:

Performed in silico mutation using Swiss PDB Viewer:  S234R, where 234 is PDB residue number (contained in peptide P) corresponding to S residue in RKSIRIQRGPGRAFVTIG

Energy minimization with Python code from 20.320 using PyRosetta:

PeptideStarting EnergyMinimized Energy
234 = S (original)409.865230046378.056398555
234 = R (mutant)408.461979863376.734455146
R/S ratio0.99660.9965

Looking more closely at PDB file SPV didn't add hydrogens with the mutation (sad) - how to fix this?

 

YU2 strain:

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MyBioSource