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ANALYSIS FOR SODIUM TETRATHIOCYANATO MERCURATE (II)  [HDD] 
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Formula           : NA2,HG1,S4,C4,N4                                   
Solution chemistry: HG1,[S1,C1,N1]4 -2                                 
All distances below are to the element HG [ mercury      ]


PROTEIN:  2CYP CYTOCHROME C PEROXIDASE (YEAST)                     


Bound Ligands :  HEM PROTOPORPHYRIN IX GROUP CONTAINS FE+++:
Hev Atom conc.: 	  30.000 mM  
Precip & conc.: 	  30.000 %	MPD                                                 
Buffer & conc.: 	   0.050 M	POTASSIUM PHOSPHATE                                 
Addict & conc.: 	          	                                                    
Comments      :                                                     
Reference     : FINZEL et.al. 1984 :POULOS et.al. 1978 :                                                                                                                
pH    6.0   Soak time =     24.00 Hours   Reference number =  96.01  
Site 1:   8  ALA   CB    5.70 ( 6.66) . . .  
      :   9  SER   O     5.99 ( 6.13) . . .  
      :  10  VAL   CG1   4.28 ( 4.37) . . .  
      :  11  GLU   OE2   5.69 ( 7.53) . . T  
      :  19  PHE   CE1   5.94 (10.07) . . T  
      : 127  ARG   O     5.72 ( 5.32) . . T  
      : 128  CYS   SG    2.22 ( 3.75) . . T  
      : 129  GLY   C     5.83 ( 4.42) . . T  
      : 276  PHE   CE1   5.46 ( 7.90) . . T  
      : 280  ALA   CB    5.07 ( 5.57) . . T  
      : 281  PRO   CD    3.70 ( 5.43) . . T  
      : 284  PHE   CE1   5.23 ( 8.93) . . T  
      : 427  HOH   O     3.23 (-1.00) . . .  
      : 428  HOH   O     2.05 (-1.00) . . .  
      : 577  HOH   O     4.23 (-1.00) . . .  
      : 727  HOH   O     3.81 (-1.00) . . .  
Site 2:  89  PHE   CE1   5.67 ( 7.60) . . T  
      :  92  LEU   O     5.31 ( 6.70) . . T  
      :  93  GLU   O     5.02 ( 4.84) . . T  
      :  96  HIS   NE2   4.32 ( 4.73) . . T  
      :  97  LYS   N     5.90 ( 6.90) . . T  
      : 104  SER   OG    4.91 ( 6.04) . . T  
      : 107  LEU   CD2   4.78 ( 7.89) . . T  
      : 108  PHE   CE2   5.74 ( 8.90) . . T  
      : 396  HOH   O     0.94 (-1.00) . . .  
      : 404  HOH   O     2.98 (-1.00) . . .  
      : 693  HOH   O     4.39 (-1.00) . . .  
      : 696  HOH   O     3.31 (-1.00) . . .  
      : 996  HOH   O     4.53 (-1.00) . . .