PDB Code: ANA

X-PLOR files

Heterogen file generated from the PDB Het Group Dictionary



PICTURE
     O1A==C1--O1B--1HOB   N5(HN5)--C10(==O10)--C11--1,3H11
 1,2H12   |  1,2H3 H4     |         H6   H7     H8  1,2H9
 C12--O2--C2--C3---C4-----C5--------C6---C7-----C8---C9--O9--HO9
          |        O4       H5      |    |      |
          |   OA4==CA4--CM4--1,3HM4 |    O7-HO7 O8-HO8
          +-------------------------O6
END

RESIDUE   ANA     48
CONECT      C1     3 C2   O1A  O1B
CONECT      C2     4 C1   C3   O2   O6
CONECT      C3     4 C2   C4  1H3  2H3
CONECT      C4     4 C3   C5   O4   H4
CONECT      C5     4 C4   C6   N5   H5
CONECT      C6     4 C5   C7   O6   H6
CONECT      C7     4 C6   C8   O7   H7
CONECT      C8     4 C7   C9   O8   H8
CONECT      C9     4 C8   O9  1H9  2H9
CONECT      C10    3 C11  N5   O10
CONECT      C11    4 C10 1H11 2H11 3H11
CONECT      C12    4 O2  1H12 2H12 3H12
CONECT      CA4    3 O4   OA4  CM4
CONECT      CM4    4 CA4 1HM4 2HM4 3HM4
CONECT      N5     3 C5   C10  HN5
CONECT      O1A    1 C1
CONECT      O1B    2 C1  1HOB
CONECT      O2     2 C2   C12
CONECT      O4     2 C4   CA4
CONECT      O6     2 C2   C6
CONECT      O7     2 C7   HO7
CONECT      O8     2 C8   HO8
CONECT      O9     2 C9   HO9
CONECT      O10    1 C10
CONECT      OA4    1 CA4
CONECT     1HOB    1 O1B
CONECT     1H3     1 C3
CONECT     2H3     1 C3
CONECT      H4     1 C4
CONECT      H5     1 C5
CONECT      H6     1 C6
CONECT      H7     1 C7
CONECT      H8     1 C8
CONECT     1H9     1 C9
CONECT     2H9     1 C9
CONECT     1H11    1 C11
CONECT     2H11    1 C11
CONECT     3H11    1 C11
CONECT     1H12    1 C12
CONECT     2H12    1 C12
CONECT     3H12    1 C12
CONECT     1HM4    1 CM4
CONECT     2HM4    1 CM4
CONECT     3HM4    1 CM4
CONECT      HN5    1 N5
CONECT      HO7    1 O7
CONECT      HO8    1 O8
CONECT      HO9    1 O9
END
HET    ANA             48
HETNAM     ANA 4-O-ACETYL-ALPHA-2-OMETHYL-5-N-ACETYL-ALPHA-D-
HETNAM   2 ANA NEURAMINIC ACID
FORMUL      ANA    C14 H23 N1 O10