Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : U81    

Bonds between two atoms of the molecule

Total Number of Bonds: 49


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 C11 C12 C C sing 1.53 N N
2 C11 C10 C C sing 1.53 N N
3 C12 N2 C N sing 1.47 N N
4 N1 C10 N C sing 1.47 N N
5 N1 C9 N C sing 1.47 N N
6 C1 C2 C C sing 1.53 N N
7 C1 C9 C C sing 1.53 N N
8 N2 C13 N C sing 1.38 N N
9 C2 O1 C O sing 1.43 N N
10 C14 C13 C C doub 1.36 N N
11 C14 C15 C C sing 1.4 N N
12 C9 C8 C C sing 1.51 N N
13 O2 C15 O C doub 1.22 N N
14 C15 C16 C C sing 1.42 N N
15 O1 C3 O C sing 1.36 N N
16 N3 C17 N C sing 1.4 N N
17 C8 C3 C C doub 1.38 N Y
18 C8 C7 C C sing 1.39 N Y
19 C16 C17 C C doub 1.38 N Y
20 C16 S1 C S sing 1.76 N Y
21 C3 C4 C C sing 1.39 N Y
22 C17 C18 C C sing 1.4 N Y
23 C7 C6 C C doub 1.38 N Y
24 S1 C19 S C sing 1.76 N Y
25 C18 C19 C C doub 1.33 N Y
26 C4 BR2 C BR sing 1.89 N N
27 C4 C5 C C doub 1.38 N Y
28 C6 C5 C C sing 1.38 N Y
29 C6 BR1 C BR sing 1.89 N N
30 C14 H1 C H sing 1.08 N N
31 C5 H3 C H sing 1.08 N N
32 C11 H4 C H sing 1.09 N N
33 C11 H5 C H sing 1.09 N N
34 C7 H6 C H sing 1.08 N N
35 C9 H7 C H sing 1.09 N N
36 C10 H8 C H sing 1.09 N N
37 C10 H9 C H sing 1.09 N N
38 C12 H10 C H sing 1.09 N N
39 C12 H11 C H sing 1.09 N N
40 N1 H12 N H sing 1.01 N N
41 N2 H14 N H sing 0.97 N N
42 C1 H15 C H sing 1.09 N N
43 C1 H16 C H sing 1.09 N N
44 C2 H17 C H sing 1.09 N N
45 C2 H18 C H sing 1.09 N N
46 C18 H19 C H sing 1.08 N N
47 C19 H20 C H sing 1.08 N N
48 N3 C13 N C sing 1.36 N N
49 N3 H2 N H sing 0.97 N N