Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0EN

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 63


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O1 O O1 N N N 0 -0.124 -3.153 0.198
2 C1 C C1 N N N 0 -0.777 -2.208 -0.205
3 C4 C C4 N Y N 0 -2.198 -2.381 -0.523
4 C5 C C5 N Y N 0 -2.936 -3.509 -0.309
5 C6 C C6 N Y N 0 -4.236 -3.232 -0.76
6 C7 C C7 N Y N 0 -4.234 -1.963 -1.223
7 O3 O O3 N Y N 0 -3.006 -1.451 -1.074
8 N1 N N1 N N N 0 -0.196 -1.001 -0.352
9 C8 C C8 N Y N 0 1.174 -0.851 -0.116
10 C9 C C9 N Y N 0 2.04 -0.602 -1.173
11 C10 C C10 N Y N 0 3.393 -0.454 -0.935
12 C11 C C11 N Y N 0 3.885 -0.554 0.353
13 C14 C C14 N N N 0 5.361 -0.392 0.608
14 C15 C C15 N N N 0 5.809 0.997 0.147
15 C16 C C16 N N N 0 5.64 -0.546 2.105
16 C17 C C17 N N N 0 6.134 -1.46 -0.168
17 C12 C C12 N Y N 0 3.026 -0.802 1.408
18 C13 C C13 N Y N 0 1.672 -0.946 1.178
19 C2 C C2 R N N 0 -0.999 0.154 -0.761
20 C3 C C3 N N N 0 -1.979 0.496 0.332
21 N2 N N2 N N N 0 -2.828 1.531 0.176
22 C23 C C23 N N N 0 -3.78 1.864 1.238
23 C24 C C24 N N N 0 -3.017 2.201 2.521
24 C25 C C25 N N N 0 -4.619 3.07 0.812
25 C26 C C26 N N N 0 -4.7 0.667 1.491
26 O2 O O2 N N N 0 -2.004 -0.16 1.351
27 C18 C C18 N Y N 0 -0.093 1.333 -1.01
28 C19 C C19 N Y N 0 -0.138 2.009 -2.22
29 C20 C C20 N Y N 0 0.714 3.087 -2.405
30 C21 C C21 N Y N 0 1.572 3.45 -1.385
31 N3 N N3 N Y N 0 1.587 2.784 -0.247
32 C22 C C22 N Y N 0 0.787 1.758 -0.034
33 H1 H H1 N N N 0 -2.588 -4.436 0.123
34 H2 H H2 N N N 0 -5.08 -3.907 -0.74
35 H3 H H3 N N N 0 -5.085 -1.445 -1.642
36 H4 H H4 N N N 0 1.656 -0.524 -2.179
37 H5 H H5 N N N 0 4.067 -0.261 -1.757
38 H6 H H6 N N N 0 5.259 1.758 0.7
39 H7 H H7 N N N 0 6.877 1.114 0.331
40 H8 H H8 N N N 0 5.61 1.107 -0.919
41 H9 H H9 N N N 0 5.321 -1.535 2.433
42 H10 H H10 N N N 0 6.708 -0.429 2.289
43 H11 H H11 N N N 0 5.09 0.215 2.657
44 H12 H H12 N N N 0 5.935 -1.35 -1.234
45 H13 H H13 N N N 0 7.202 -1.343 0.017
46 H14 H H14 N N N 0 5.815 -2.45 0.161
47 H15 H H15 N N N 0 3.414 -0.879 2.413
48 H16 H H16 N N N 0 1.0 -1.135 2.003
49 H17 H H17 N N N 0 -1.543 -0.086 -1.674
50 H18 H H18 N N N 0 -2.808 2.057 -0.639
51 H19 H H19 N N N 0 -2.362 3.053 2.34
52 H20 H H20 N N N 0 -3.726 2.448 3.311
53 H21 H H21 N N N 0 -2.42 1.342 2.825
54 H22 H H22 N N N 0 -5.163 2.83 -0.102
55 H23 H H23 N N N 0 -5.328 3.317 1.602
56 H24 H H24 N N N 0 -3.964 3.923 0.631
57 H25 H H25 N N N 0 -4.102 -0.192 1.795
58 H26 H H26 N N N 0 -5.409 0.914 2.282
59 H27 H H27 N N N 0 -5.243 0.427 0.578
60 H28 H H28 N N N 0 -0.819 1.702 -3.0
61 H29 H H29 N N N 0 0.706 3.636 -3.335
62 H30 H H30 N N N 0 2.238 4.289 -1.521
63 H31 H H31 N N N 0 0.824 1.24 0.913