Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : BOU    

Bonds between two atoms of the molecule

Total Number of Bonds: 55


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 C1 S1 C S sing 1.84 N N
2 C1 C7 C C sing 1.53 N N
3 C2 C1 C C sing 1.54 N N
4 N1 C2 N C sing 1.47 N N
5 N1 C3 N C sing 1.49 N N
6 C3 S1 C S sing 1.84 N N
7 C3 C4 C C sing 1.53 N N
8 C4 N2 C N sing 1.46 N N
9 C5 C4 C C sing 1.51 N N
10 C5 O1 C O doub 1.21 N N
11 C6 C1 C C sing 1.53 N N
12 C8 C2 C C sing 1.51 N N
13 C8 O2 C O sing 1.34 N N
14 O3 C8 O C doub 1.21 N N
15 N2 C9 N C sing 1.35 N N
16 C9 C10 C C sing 1.48 N N
17 O4 C9 O C doub 1.22 N N
18 C10 C11 C C doub 1.39 N Y
19 C10 C15 C C sing 1.41 N Y
20 C11 C12 C C sing 1.38 N Y
21 C12 C13 C C doub 1.39 N Y
22 C14 C13 C C sing 1.38 N Y
23 C15 C14 C C doub 1.39 N Y
24 C16 C15 C C sing 1.48 N N
25 C16 C21 C C sing 1.41 N Y
26 C17 C16 C C doub 1.39 N Y
27 C18 C17 C C sing 1.38 N Y
28 C18 C19 C C doub 1.38 N Y
29 C19 C20 C C sing 1.38 N Y
30 C20 C21 C C doub 1.39 N Y
31 C21 C22 C C sing 1.48 N N
32 C22 O5 C O sing 1.35 N N
33 O6 C22 O C doub 1.22 N N
34 C2 H3 C H sing 1.09 N N
35 N1 HN4 N H sing 1.01 N N
36 C3 H5 C H sing 1.09 N N
37 C4 H6 C H sing 1.09 N N
38 C5 HO8 C H sing 1.08 N N
39 C6 H9 C H sing 1.09 N N
40 C6 H9A C H sing 1.09 N N
41 C6 H9B C H sing 1.09 N N
42 C7 H10 C H sing 1.09 N N
43 C7 H10A C H sing 1.09 N N
44 C7 H10B C H sing 1.09 N N
45 O2 HO12 O H sing 0.97 N N
46 N2 HN14 N H sing 0.97 N N
47 C11 H18 C H sing 1.08 N N
48 C12 H19 C H sing 1.08 N N
49 C13 H20 C H sing 1.08 N N
50 C14 H21 C H sing 1.08 N N
51 C17 H24 C H sing 1.08 N N
52 C18 H25 C H sing 1.08 N N
53 C19 H26 C H sing 1.08 N N
54 C20 H27 C H sing 1.08 N N
55 O5 HO30 O H sing 0.97 N N