Thank you for such great explanation. Hopefully people won't consider me
hijacking this thread.
Nian

On Sun, Apr 17, 2011 at 11:08 AM, Artem Evdokimov <[email protected]
> wrote:

> TCEP relies on a completely different chemistry to achieve the same goal as
> BME or DTT.
> DTT/BME use S(-)>SS with redox potentials of -0.26 to -0.33 V (at pH 7)
> whereasTCEP uses P(3+)->P(5+) oxidation with redox potential that's a lot
> higher (I don't know of a reference with a stated redox potential for this
> system) because TCEP readily reduces oxidized forms of both DTT and BME in
> solution. TCEP also does not readly break S-Hg bonds unlike DTT or BME.
>
> TCEP does not readily react with oxygen in solution (both DTT and BME react
> rapidly) and has long shelf life as buffered 1M solution at pH 5.6-6.3.
>
> TCEP has two non-trivial disadvantages that are for the most part not
> relevant for the purposes of crystallography: one is that it does not work
> very well in high Phosphate concentration, and the other is that it hinders
> the reaction of thiols with haloacetamides and suchlike (because it itself
> can react with haloacetamides). If you're labeling with haloacetamides you
> may want to use tri- tertbutul phosphine instead (it's much less soluble
> than TCEP, but 1 mM solution in water can be made).
>  TCEP does not permeate biological membranes and therefore has been used
> to reduce thiols outside the cell while keeping intracellular ones intact.
> Due to its size and charge, it also is quite selective which protein
> disulphides are readily reduced - ones on or near protein surface are
> reduced quickly whereas buried or shielded ones are often not reduced at all
> w/o the use of a chaotrope. That's rather useful to us as it often allows us
> to reduce the unwanted inter-molecular disulphides (bad: aggregates) while
> at the same time preserve the valuable intra-molecular ones (good:
> structure)
>
> Artem
> On Sat, Apr 16, 2011 at 11:46 PM, Nian Huang <[email protected]> wrote:
>
>> Dear Horacio,
>> How does TECEP compare to  BME or DTT? People claim it is better, but I
>> want some crystallographers' opinion?
>>
>> Nian
>>
>> On Sat, Apr 16, 2011 at 4:24 PM, Horacio Botti <[email protected]>wrote:
>>
>>> Dear Mike
>>>
>>> BME readily autooxidizes (need for metal traces and dissolved O2). Is
>>> yours a metalloprotein? Is your buffer contaminated with metals? Those
>>> situations would make the case a bit different. If not, unless your BME
>>> stock is already oxidized, blocking of the accesible thiols with BME should
>>> take some time. If you treat your protein for 40 min with fresh BME you
>>> should not observe thiol blocking. If you let the preparation to stay for
>>> several days, even at 4-6 °C you may observe the blocking that you may be
>>> observing.
>>>
>>> If you want to prevent Cys blocking you can also change to DTT (it is a
>>> dithiol, does not readily form mixed disulfides) and use it with caution
>>> (for thiol reduction it is advisable to use stoichiometric DTT (with respect
>>> to the number of Cys you need to reduce) and 10 fold excess of BME, look for
>>> their redox potentials). Take care of not "over-reducing" your protein if
>>> internal disulfide bonds are expected. Once reduced I suggest you to remove
>>> any reducing agent and store the protein at -80 °C.
>>>
>>> External Cys can be easily oxidized, they are highly expossed to metals
>>> and oxidants (H2O2, BME disulfides, etc). Diffusion is for sure much faster
>>> than SS bond formation, although some cys react at almost
>>> diffusion-controlled rates with oxidants (is yours a thiol'dependen t
>>> peroxidase?) You can take a look at the following reference (advertising):
>>>
>>> 2011. Factors Affecting Protein Thiol Reactivity and Specificity in
>>> Peroxide Reduction. Chem Res Toxicol.
>>>
>>> Metals can contaminate bad quality materials (water, salts, buffers,
>>> etc), take care of that too. If you need to control the redox state of your
>>> protein you should use DTNB (Ellman´s reagent), or DTDPy, to measure
>>> accesible reduced thiol groups.
>>>
>>> Good luck!
>>>
>>> Horacio
>>>
>>>
>>>
>>>
>>> Quoting Kendall Nettles <[email protected]>:
>>>
>>> We see BME adducts in all of our estrogen receptor structures,  though we
>>>> don't always put them in the models. Sometimes we only see  one or two 
>>>> atoms
>>>> of the adduct, and in others it is completely  ordered. We only see it on
>>>> the solvent accessible cysteines. We do  it on purpose. We used to treat 
>>>> the
>>>> protein with iodoacetic acid to  generate uniform modification of the
>>>> cysteines, but then we realized  we could get then same homogeneity with
>>>> 20-50mM BME.
>>>>
>>>> Kendall Nettles
>>>>
>>>> On Apr 15, 2011, at 4:09 PM, "Michael Thompson" <[email protected]>
>>>> wrote:
>>>>
>>>> Hi All,
>>>>>
>>>>> I was wondering if anyone knew whether or not it is possible for
>>>>>  reducing agents with thiol groups, such as DTT or  beta-mercaptoethanol
>>>>> (BME), to form covalent S-S bonds with Cys  residues, particularly
>>>>> solvent-exposed Cys? I have some puzzling  biochemical results, and in the
>>>>> absence of a structure (thus far),  I was wondering if this might be
>>>>> something to try to control for. I  have never heard of this happening (or
>>>>> seen a structure where there  was density for this type of adduct), but I
>>>>> can't really think of a  good reason for why this wouldn't happen.
>>>>> Especially for something  like BME, where the molecule is very much like 
>>>>> the
>>>>> Cys sidechain  and seems to me like it should have similar reactivity. The
>>>>> only  thing I can think of is if there is a kinetic effect taking place.
>>>>>  Perhaps the rate of diffusion of these small molecules is much  faster 
>>>>> that
>>>>> the formation of the S-S bond?
>>>>>
>>>>> Does anyone know whether or not this is possible, and why it does  or
>>>>> does not happen?
>>>>>
>>>>> Thanks,
>>>>>
>>>>> Mike
>>>>>
>>>>>
>>>>>
>>>>>
>>>>> --
>>>>> Michael C. Thompson
>>>>>
>>>>> Graduate Student
>>>>>
>>>>> Biochemistry & Molecular Biology Division
>>>>>
>>>>> Department of Chemistry & Biochemistry
>>>>>
>>>>> University of California, Los Angeles
>>>>>
>>>>> [email protected]
>>>>>
>>>>
>>>>
>>
>

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