PDB Code: BAP
X-PLOR files
Heterogen file generated from the PDB Het Group Dictionary
RESIDUE BAP 39
CONECT C1 3 C2 C1A H1
CONECT C2 3 C1 C3 H2
CONECT C3 3 C2 C3A H3
CONECT C3A 3 C3 C4 C3B
CONECT C4 3 C3A C5 H4
CONECT C5 3 C4 C5A H5
CONECT C5A 3 C5 C6 C5B
CONECT C6 3 C5A C7 C4'
CONECT C7 3 C6 C8 C1'
CONECT C8 3 C7 C8A H8
CONECT C8A 3 C8 C9 C5B
CONECT C9 3 C8A C10 H9
CONECT C10 3 C9 C1A H10
CONECT C1A 3 C1 C10 C3B
CONECT C3B 3 C3A C5B C1A
CONECT C5B 3 C5A C8A C3B
CONECT C1' 4 C7 C2' O1' H1'
CONECT O1' 2 C1' HO1
CONECT C2' 4 C1' C3' O2' H2'
CONECT O2' 2 C2' HO2
CONECT C3' 4 C2' C4' O3' H3'
CONECT O3' 2 C3' HO3
CONECT C4' 4 C6 C3' 1H4' 2H4'
CONECT H1 1 C1
CONECT H2 1 C2
CONECT H3 1 C3
CONECT H4 1 C4
CONECT H5 1 C5
CONECT H8 1 C8
CONECT H9 1 C9
CONECT H10 1 C10
CONECT H1' 1 C1'
CONECT HO1 1 O1'
CONECT H2' 1 C2'
CONECT HO2 1 O2'
CONECT H3' 1 C3'
CONECT HO3 1 O3'
CONECT 1H4' 1 C4'
CONECT 2H4' 1 C4'
END
HET BAP 39
HETNAM BAP 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE
FORMUL BAP C20 H16 O3