Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : 0MS    

Bonds between two atoms of the molecule

Total Number of Bonds: 52


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 BR2 C11 BR C sing 1.89 N N
2 C11 C5 C C doub 1.39 N Y
3 C11 C6 C C sing 1.38 N Y
4 C5 C9 C C sing 1.38 N Y
5 C6 N22 C N doub 1.32 N Y
6 C9 C20 C C sing 1.51 N N
7 C9 C14 C C doub 1.39 N Y
8 N22 C14 N C sing 1.32 N Y
9 C14 N24 C N sing 1.39 N N
10 N24 C17 N C sing 1.47 N N
11 N24 C16 N C sing 1.47 N N
12 C17 C19 C C sing 1.53 N N
13 C19 N25 C N sing 1.47 N N
14 C16 C18 C C sing 1.53 N N
15 N25 C18 N C sing 1.47 N N
16 N25 C15 N C sing 1.35 N N
17 C15 O26 C O doub 1.22 N N
18 C15 C8 C C sing 1.47 N N
19 C2 C4 C C doub 1.38 N Y
20 C2 C1 C C sing 1.38 N Y
21 C4 C10 C C sing 1.38 N Y
22 C1 C3 C C doub 1.38 N Y
23 C10 CL2 C CL sing 1.74 N N
24 C10 C7 C C doub 1.39 N Y
25 C8 C12 C C sing 1.48 N Y
26 C8 C13 C C doub 1.37 N Y
27 C3 C7 C C sing 1.39 N Y
28 C7 C12 C C sing 1.48 N N
29 C12 N23 C N doub 1.31 N Y
30 C13 C21 C C sing 1.51 N N
31 C13 O27 C O sing 1.34 N Y
32 N23 O27 N O sing 1.21 N Y
33 C1 H1 C H sing 1.08 N N
34 C2 H2 C H sing 1.08 N N
35 C3 H3 C H sing 1.08 N N
36 C4 H4 C H sing 1.08 N N
37 C5 H5 C H sing 1.08 N N
38 C6 H6 C H sing 1.08 N N
39 C16 H7 C H sing 1.09 N N
40 C16 H8 C H sing 1.09 N N
41 C17 H9 C H sing 1.09 N N
42 C17 H10 C H sing 1.09 N N
43 C18 H11 C H sing 1.09 N N
44 C18 H12 C H sing 1.09 N N
45 C19 H13 C H sing 1.09 N N
46 C19 H14 C H sing 1.09 N N
47 C20 H15 C H sing 1.09 N N
48 C20 H16 C H sing 1.09 N N
49 C20 H17 C H sing 1.09 N N
50 C21 H18 C H sing 1.09 N N
51 C21 H19 C H sing 1.09 N N
52 C21 H20 C H sing 1.09 N N