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. Author manuscript; available in PMC: 2010 Jan 23.
Published in final edited form as: Gene. 2005 Dec 15;365:95–103. doi: 10.1016/j.gene.2005.09.028

Table 5.

The λmax values (nm) of chicken (P415) pigment, evaluated by ONIOM (TD-B3LYP/6-31G*: Amber94)/ONIOM(B3LYP/6-31G) method

The Schiff base Wild type
Mutant (S90C)
H2O No H2O H2O No H2O
Unprotonated 398 386 397 380
Protonated 512 514 506 521