KEGG   RPAIR: RP02695Help
Entry
RP02695                     RPair                                  

Name
C00870_C03360
Compound
C00870  
4-Nitrophenol
C03360  
4-Nitrophenyl phosphate
Type
main
RDM
1
1     O1a-O2b:*-P1b:C8y-C8y
RClass
Related pair
Reaction
Enzyme
3.1.3.1      3.1.3.2      3.1.3.41
KCF data Show

ALIGN       10
            1     1:C8y  11:C8y
            2     2:N2b  12:N2b
            3     3:C8x   9:C8x
            4     4:C8x  10:C8x
            5     5:O3a  13:O3a
            6     6:O3a  14:O3a
            7     7:C8x   7:C8x
            8     8:C8x   8:C8x
            9     9:C8y   6:C8y #M1
            10   10:O1a   2:O2b #R1
            -       *     1:P1b #D1
ENTRY1      
 COMPOUND  C00870
 ATOM      10
            1   C8y C     0.0000   -0.3828
            2   N2b N    -0.0034   -1.1310 #+
            3   C8x C    -0.6483    0.0000
            4   C8x C     0.6586    0.0000
            5   O3a O     0.6414   -1.5138
            6   O3a O    -0.6517   -1.5103 #-
            7   C8x C    -0.6483    0.7586
            8   C8x C     0.6586    0.7586
            9   C8y C     0.0000    1.1345
            10  O1a O    -0.0034    1.8828
 BOND      10
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 2
            8     7   9 2
            9     9  10 1
            10    8   9 1
ENTRY2      
 COMPOUND  C03360
 ATOM      14
            1   P1b P    -0.0103    2.0138
            2   O2b O    -0.0034    1.1897
            3   O1c O     0.8586    1.9897
            4   O1c O    -0.8069    1.9931
            5   O1c O    -0.0138    2.8379
            6   C8y C    -0.0034    0.3621
            7   C8x C    -0.7172   -0.0483
            8   C8x C     0.7207   -0.0483
            9   C8x C    -0.7172   -0.8828
            10  C8x C     0.7207   -0.8828
            11  C8y C    -0.0034   -1.3035
            12  N2b N    -0.0034   -2.1276 #+
            13  O3a O     0.7034   -2.5448
            14  O3a O    -0.7207   -2.5448 #-
 BOND      14
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 2
            5     2   6 1
            6     6   7 2
            7     6   8 1
            8     7   9 1
            9     8  10 2
            10    9  11 2
            11   11  12 1
            12   12  13 2
            13   12  14 1
            14   10  11 1

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