Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KW9

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 43


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 3.652 2.13 0.654
2 C4 C C1 N Y N 0 -6.344 -0.513 1.512
3 C5 C C2 N Y N 0 -5.067 -0.964 1.233
4 C6 C C3 N Y N 0 -4.383 -0.471 0.133
5 C7 C C4 N N N 0 -2.573 -1.888 0.744
6 C8 C C5 N N N 0 -1.165 -2.261 0.275
7 C10 C C6 N N N 0 1.922 -0.04 0.244
8 C13 C C7 N Y N 0 4.199 0.943 0.215
9 C15 C C8 N Y N 0 6.088 -0.371 -0.455
10 C17 C C9 N Y N 0 3.915 -1.376 -0.448
11 F F F1 N N N 0 7.416 -0.481 -0.679
12 C14 C C10 N Y N 0 5.565 0.829 -0.016
13 C16 C C11 N Y N 0 5.26 -1.468 -0.669
14 C18 C C12 N Y N 0 3.366 -0.171 -0.003
15 C12 C C13 N N N 0 2.333 2.246 0.885
16 O3 O O1 N N N 0 1.89 3.312 1.272
17 C11 C C14 N N N 0 1.446 1.16 0.689
18 C9 C C15 N N N 0 1.008 -1.188 0.027
19 O2 O O2 N N N 0 1.426 -2.212 -0.474
20 N N N2 N N N 0 -0.288 -1.094 0.386
21 O1 O O3 N N N 0 -3.127 -0.914 -0.143
22 C1 C C16 N Y N 0 -4.985 0.477 -0.689
23 O O O4 N N N 0 -4.318 0.964 -1.77
24 C C C17 N N N 0 -4.997 1.935 -2.568
25 C3 C C18 N Y N 0 -6.941 0.429 0.695
26 H3 H H3 N N N 0 -4.602 -1.7 1.872
27 C2 C C19 N Y N 0 -6.265 0.925 -0.404
28 H1 H H1 N N N 0 4.231 2.895 0.803
29 H2 H H2 N N N 0 -6.878 -0.901 2.367
30 H4 H H4 N N N 0 -3.204 -2.777 0.746
31 H5 H H5 N N N 0 -2.524 -1.476 1.751
32 H6 H H6 N N N 0 -0.777 -3.068 0.898
33 H7 H H7 N N N 0 -1.203 -2.591 -0.763
34 H8 H H8 N N N 0 3.279 -2.232 -0.617
35 H9 H H9 N N N 0 6.215 1.676 0.147
36 H10 H H10 N N N 0 5.684 -2.4 -1.013
37 H11 H H11 N N N 0 0.391 1.283 0.883
38 H12 H H12 N N N 0 -0.64 -0.252 0.718
39 H13 H H13 N N N 0 -4.355 2.238 -3.395
40 H14 H H14 N N N 0 -5.917 1.502 -2.962
41 H15 H H15 N N N 0 -5.237 2.804 -1.957
42 H16 H H16 N N N 0 -7.939 0.779 0.916
43 H17 H H17 N N N 0 -6.734 1.661 -1.04