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ANALYSIS FOR PARA-CARBOXYMETHYL MERCAPTOMERCURI BENZ [HCW]
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Formula : C8,H7,S2,O5,HG1,S2,F1
Solution chemistry: [C6,H4]1,[S1,O3]1,[(HG1),(S1),(C1,H2),(C1,O2)]1 -2
All distances below are to the element HG [ mercury ]
PROTEIN: 1SBT SUBTILISIN BPN'
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Hev Atom conc.: 3.000 mM
Precip & conc.: 2.100 M AMMONIUM SULPHATE
Buffer & conc.: 0.050 M ACETATE
Addict & conc.:
Comments : ACTIVE CRYSTALS USED
Reference : WRIGHT et.al. 1969 :
pH 5.9 Soak time = 240.00 Hours Reference number = 248.03
Site 1: 155 ASN OD1 5.14 ( 7.00) . . .
: 189 PHE CD2 5.94 ( 8.20) . . .
: 218 ASN O 2.45 ( 4.78) . . .
: 219 GLY C 5.58 ( 4.25) . . .
: 220 THR N 5.84 ( 7.25) . . .
: 222 MET SD 5.57 ( 8.62) . . .
: 202 HOH O 4.28 (-1.00) . . .
: 203 HOH O 2.02 (-1.00) . . .
: 205 HOH O 5.92 (-1.00) . . .
Site 2: 62 ASN O 4.83 ( 6.75) . . .
: 64 HIS NE2 5.40 ( 5.99) . . H
: 217 TYR OH 4.66 ( 7.86) . . .