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. Author manuscript; available in PMC: 2013 Aug 20.
Published in final edited form as: Chem Res Toxicol. 2012 Jul 26;25(8):1752–1761. doi: 10.1021/tx300215g

Table 1.

CBDP adducts on residues in human albumin.

Sequence
position
Peptide sequence Labeled

residue
Mass of
unlabeled
peptide,
m/z
Mass of
labeled
peptide,
m/z
(mass
shift)
Adduct Method of
identification
65–73 SLH*TLFGDK H67 1017.6 1123.6
(+106)
o-
Hydroxybenzyl
LTQ-
Orbitrap
65–73 SLH*TLFGDK H67 1017.6 1229.6
(+212)
Concatenated-
[2]-o-
hydroxybenzyl
MALDI
MSMS,
LTQ-
Orbitrap
138–144 Y*LYEIAR Y138 927.5 1097.5
(+170)
o-Cresyl
phosphate
MALDI
MSMS,
LTQ-
Orbitrap
138–144 YLY*EIAR Y140 927.5 1097.5
(+170)
o-Cresyl
phosphate
MALDI
MSMS,
LTQ-
Orbitrap
146–159 H*PYFYAPELLFFAK H146 1742.9 1848.9
(+106)
o-
Hydroxybenzyl
MALDI
MSMS,
LTQ-
Orbitrap
145–159 RH*PYFYAPELLFFAK H146 1899.0 2005.0
(+106)
o-
Hydroxybenzyl
LTQ-
Orbitrap
198–205 LK*CASLQK K199 947.5 1223.6
(+276)
Ring-opened MALDI,

LTQ-
Orbitrap
241–257 VH*TECCHGDLLECADDR H242 2086.8 2192.9
(+106)
o-
Hydroxybenzyl
MALDI
MSMS,
LTQ-
Orbitrap
246–257 CH*GDLLECADDR H247 1460.5 1566.6
(+106)
o-
Hydroxybenzyl
LTQ-
Orbitrap
338–348 H*PDYSVVLLLR H338 1311.7 1417.8
(+106)
o-
Hydroxybenzyl
MALDI
MSMS,
LTQ-
Orbitrap
338–348 H*PDYSVVLLLR H338 1311.7 1523.9
(+212)
Concatenated-
[2]-o-
hydroxybenzyl
MALDI,

LTQ-
Orbitrap
337–348 RH*PDYSVVLLLR H338 1467.8 1573.9

(+106)
o-
Hydroxybenzyl
MALDI
MSMS,
LTQ-
Orbitrap
349–359 LAK*TYETTLEK K351 1296.7 1572.8
(+276)
Ring-opened LTQ-
Orbitrap
414–428 K*VPQVSTPTLVEVSR K414 1640.0 1916.0
(+276)
Ring-opened LTQ-
Orbitrap
429–436 NLGK*VGSK K432 802.5 1078.5
(+276)
Ring-opened LTQ-
Orbitrap
525–534 K*QTALVELVK K525 1128.7 1234.7
(+106)
o-
Hydroxybenzyl
LTQ-
Orbitrap
525–534 K*QTALVELVK K525 1128.7 1340.8
(+212)
Concatenated-
[2]-o-
hydroxybenzyl
LTQ-
Orbitrap
525–534 K*QTALVELVK K525 1128.7 1404.6

(+276)
Ring-opened LTQ-
Orbitrap

The asterisk * indicates the adducted residue. Residue numbering is for mature albumin without the signal peptide, as found in accession number gi:122920512 in the NCBI protein database. The complete albumin sequence including Lys 199 is in SwissProt P02768. Monoisotopic masses of singly charged ions are given. Cysteines are carbamidomethylated, adding a mass of +57 amu.