Chemical Components in the PDB

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PDBeChem : Chemical Bonds

 Molecule : ITB    

Bonds between two atoms of the molecule

Total Number of Bonds: 34


Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 C1 C2 C C doub 1.41 N Y
2 C1 C10 C C sing 1.41 N Y
3 C1 C6 C C sing 1.42 N Y
4 C10 C14 C C sing 1.49 N N
5 C10 C9 C C doub 1.4 N Y
6 C14 O19 C O doub 1.22 N N
7 C14 N15 C N sing 1.44 N N
8 N15 C20 N C sing 1.47 N N
9 N15 S16 N S sing 1.71 N N
10 C20 C21 C C sing 1.5 N N
11 C20 H201 C H sing 1.09 N N
12 C20 H202 C H sing 1.09 N N
13 C21 O22 C O doub 1.22 N N
14 C21 O23 C O sing 1.36 N N
15 O23 HO23 O H sing 0.98 N N
16 S16 O18 S O doub 1.45 N N
17 S16 O17 S O doub 1.45 N N
18 S16 C9 S C sing 1.74 N N
19 C9 C8 C C sing 1.38 N Y
20 C8 C7 C C doub 1.39 N Y
21 C8 C11 C C sing 1.45 N N
22 C11 O13 C O doub 1.23 N N
23 C11 O12 C O sing 1.36 N N
24 O12 HO12 O H sing 0.98 N N
25 C7 C6 C C sing 1.41 N Y
26 C7 H7 C H sing 1.09 N N
27 C6 C5 C C doub 1.4 N Y
28 C5 C4 C C sing 1.39 N Y
29 C5 H5 C H sing 1.09 N N
30 C4 C3 C C doub 1.39 N Y
31 C4 H4 C H sing 1.09 N N
32 C3 C2 C C sing 1.4 N Y
33 C3 H3 C H sing 1.09 N N
34 C2 H2 C H sing 1.09 N N