Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 14L

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 45


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C14 C C14 N N N 0 -2.101 -1.532 -0.033
2 C13 C C13 S N N 0 -3.47 -1.266 -0.663
3 O13 O O13 N N N 0 -3.313 -0.724 -1.972
4 C12 C C12 S N N 0 -4.185 -0.264 0.249
5 O12 O O12 N N N 0 -5.55 -0.129 -0.156
6 C11 C C11 S N N 0 -3.473 1.078 0.131
7 O11 O O11 N N N 0 -3.873 1.905 1.231
8 C16 C C16 N Y N 0 -1.971 0.96 0.136
9 C10 C C10 N Y N 0 -1.257 2.146 0.145
10 C17 C C17 N Y N 0 0.138 2.134 0.117
11 C18 C C18 N Y N 0 0.815 0.895 0.094
12 C9 C C9 N Y N 0 0.87 3.347 0.11
13 C8 C C8 N Y N 0 2.214 3.342 -0.014
14 C20 C C20 N Y N 0 2.921 2.121 -0.116
15 C21 C C21 N Y N 0 2.223 0.894 -0.034
16 C7 C C7 N Y N 0 4.308 2.11 -0.304
17 C6 C C6 N Y N 0 4.985 0.914 -0.39
18 C5 C C5 N Y N 0 4.316 -0.293 -0.282
19 C22 C C22 N Y N 0 2.939 -0.318 -0.089
20 C23 C C23 N Y N 0 2.22 -1.592 0.084
21 C4 C C4 N Y N 0 2.916 -2.799 0.042
22 C3 C C3 N Y N 0 2.257 -3.984 0.28
23 C2 C C2 N Y N 0 0.906 -3.974 0.581
24 C1 C C1 N Y N 0 0.199 -2.789 0.594
25 C24 C C24 N Y N 0 0.821 -1.584 0.284
26 C19 C C19 N Y N 0 0.083 -0.312 0.166
27 C15 C C15 N Y N 0 -1.311 -0.256 0.114
28 H14 H H14 N N N 0 -2.263 -1.964 0.954
29 H15 H H15 N N N 0 -1.557 -2.22 -0.674
30 H13 H H13 N N N 0 -4.036 -2.197 -0.707
31 HO13 H HO13 N N N 0 -2.833 -1.301 -2.582
32 H12 H H12 N N N 0 -4.144 -0.617 1.281
33 HO12 H HO12 N N N 0 -6.059 0.493 0.382
34 H11 H H11 N N N 0 -3.786 1.567 -0.794
35 HO11 H HO11 N N N 0 -3.464 2.781 1.233
36 H10 H H10 N N N 0 -1.783 3.088 0.157
37 H9 H H9 N N N 0 0.344 4.286 0.194
38 H8 H H8 N N N 0 2.754 4.276 -0.029
39 H7 H H7 N N N 0 4.85 3.041 -0.376
40 H6 H H6 N N N 0 6.054 0.916 -0.54
41 H5 H H5 N N N 0 4.871 -1.217 -0.349
42 H4 H H4 N N N 0 3.974 -2.812 -0.177
43 H3 H H3 N N N 0 2.794 -4.919 0.235
44 H2 H H2 N N N 0 0.396 -4.899 0.806
45 H1 H H1 N N N 0 -0.838 -2.834 0.883