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ANALYSIS FOR POTASSIUM TETRATHIOCYANATO MERCURATE (I [HDC] 
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Formula           : K2,HG1,S4,C4,N4                                    
Solution chemistry: HG1,[S1,C1,N1]4 -2                                 
All distances below are to the element HG [ mercury      ]


PROTEIN:  1ECD ERYTHROCRUORIN (REDUCED, DEOXY)                     


Bound Ligands :  HEM PROTOPORPHYRIN IX WITH FE2+ AND WATER:
Hev Atom conc.: 	 75% SATURATION  
Precip & conc.: 	   3.750 M	PHOSPHATE                                           
Buffer & conc.: 	   0.000 M	                                                    
Addict & conc.: 	   0.000 M	                                                    
Comments      :                                                     
Reference     : HUBER et.al. 1968 :1969 :1971 :                                                                                                                         
pH    7.0   Soak time =           Hours   Reference number = 112.02  
Site 1:  18  GLY   O     5.65 ( 6.15) . . .  
      :  16  HOH   O     5.48 (-1.00) . . .  
Site 2:  39  HOH   O     4.29 (-1.00) . . .  


PROTEIN:  1MBA MET - MYOGLOBIN (APLYSIA LIMACINA)                  


Bound Ligands :  HEM PROTOPORPHYRIN IX WITH FE3+:
Hev Atom conc.: 	   0.300 mM  
Precip & conc.: 	   3.800 M	AMMONIUM SULPHATE                                   
Buffer & conc.: 	   0.050 M	SODIUM ACTATE                                       
Addict & conc.: 	          	                                                    
Comments      :                                                     
Reference     : BOLOGNESI et.al. 1989 :UNGARETTI et.al. 1978 :                                                                                                          
pH    6.5   Soak time =     40.00 Hours   Reference number = 327.00  
Site 1:  19  ALA   O     5.77 ( 6.75) . . .  
      :  33  PHE   CD1   5.62 ( 5.32) . . H  
      :  36  PHE   O     5.67 ( 7.34) . . .  
      :  37  PRO   CG    5.55 ( 3.96) . . 5  
      :  38  ASP   C     5.98 ( 5.84) . . 5  
      :  40  ALA   CB    3.72 ( 4.83) . . 5  
      :  41  ASN   OD1   5.56 ( 6.81) . . 5  
      :  46  PHE   O     5.83 ( 7.74) . . .  
      :  49  LYS   O     3.93 ( 6.25) . . .  
      :  50  SER   C     5.51 ( 5.45) . . .  
      :  51  VAL   N     5.42 ( 6.03) . . H  
      :  54  ILE   CD1   4.95 ( 8.52) . . H  
      : 250  HOH   O     5.88 (-1.00) . . .  
Site 2:  34  GLU   O     4.51 ( 6.83) . . H  
      :  35  LYS   O     3.34 ( 4.86) . . H  
      :  36  PHE   C     5.72 ( 5.13) . . .  
      :  37  PRO   CD    3.63 ( 6.00) . . 5  
      : 193  HOH   O     3.22 (-1.00) . . .  
      : 198  HOH   O     4.93 (-1.00) . . .  
      : 241  HOH   O     4.16 (-1.00) . . .  
      : 270  HOH   O     2.91 (-1.00) . . .  
      :   1  SER   OG    5.35 ( 6.06) . . .  
      : 132  LYS   NZ    5.75 (10.26) . . H  
      : 163  HOH   O     3.73 (-1.00) . . .  
      : 169  HOH   O     4.01 (-1.00) . . .  
      : 191  HOH   O     5.76 (-1.00) . . .  
      : 243  HOH   O     4.11 (-1.00) . . .  
Site 3:  26  LEU   O     5.26 ( 7.20) . . H  
      :  29  LEU   O     4.72 ( 5.90) . . H  
      :  30  VAL   CG1   2.68 ( 2.84) . . H  
      :  31  ALA   N     5.08 ( 6.29) . . H  
      :  33  PHE   CE2   5.28 ( 5.89) . . H  
      :  34  GLU   OE1   5.74 ( 6.76) . . H  
      :  51  VAL   CG1   2.94 ( 4.59) . . H  
      :  52  ALA   N     5.93 ( 6.60) . . H  
      :  54  ILE   CD1   5.39 ( 5.26) . . H  
      :  55  LYS   NZ    5.39 ( 4.82) . . H  
      :  60  LEU   CD1   5.53 ( 8.27) . . H