Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : 3I6    

Bonds between two atoms of the molecule

Total Number of Bonds: 40


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 O15 C14 O C sing 1.43 N N
2 C14 C13 C C sing 1.53 N N
3 C13 C15 C C sing 1.53 N N
4 C13 N9 C N sing 1.47 N N
5 N9 C9 N C sing 1.39 N N
6 C9 N10 C N sing 1.33 N Y
7 C9 C8 C C doub 1.4 N Y
8 N10 C11 N C doub 1.32 N Y
9 C8 BR1 C BR sing 1.89 N N
10 C8 C7 C C sing 1.38 N Y
11 C7 N12 C N doub 1.32 N Y
12 N12 C11 N C sing 1.33 N Y
13 C11 N1 C N sing 1.39 N N
14 N1 C2 N C sing 1.4 N N
15 C2 C3 C C sing 1.39 N Y
16 C2 C1 C C doub 1.39 N Y
17 C3 C4 C C doub 1.38 N Y
18 C4 C5 C C sing 1.38 N Y
19 C1 C6 C C sing 1.38 N Y
20 C6 C5 C C doub 1.38 N Y
21 C5 S1 C S sing 1.76 N N
22 S1 O2 S O doub 1.42 N N
23 S1 O3 S O doub 1.42 N N
24 S1 N4 S N sing 1.66 N N
25 O15 H15 O H sing 0.97 N N
26 C14 H141 C H sing 1.09 N N
27 C14 H142 C H sing 1.09 N N
28 C13 H13 C H sing 1.09 N N
29 C15 H151 C H sing 1.09 N N
30 C15 H152 C H sing 1.09 N N
31 C15 H153 C H sing 1.09 N N
32 N9 H9 N H sing 0.97 N N
33 C7 H7 C H sing 1.08 N N
34 N1 H1 N H sing 0.97 N N
35 C3 H3 C H sing 1.08 N N
36 C1 HA C H sing 1.08 N N
37 C4 H4 C H sing 1.08 N N
38 C6 H6 C H sing 1.08 N N
39 N4 H41N N H sing 0.97 N N
40 N4 H42N N H sing 0.97 N N