Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : U0I

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 53


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C02 C C1 N N N 0 4.133 -2.793 0.119
2 C04 C C2 N N N 0 3.712 -0.568 -0.492
3 C05 C C3 N N N 0 4.254 0.787 -0.869
4 C06 C C4 N Y N 0 3.108 1.732 -1.124
5 C07 C C5 N Y N 0 2.524 2.411 -0.072
6 C08 C C6 N N N 0 3.032 2.206 1.332
7 C12 C C7 N Y N 0 1.473 3.278 -0.306
8 C13 C C8 N Y N 0 1.006 3.466 -1.594
9 C14 C C9 N Y N 0 1.591 2.787 -2.647
10 C15 C C10 N Y N 0 2.645 1.925 -2.413
11 C17 C C11 N N N 0 1.865 -1.913 -0.113
12 C18 C C12 N N N 0 0.392 -2.054 -0.068
13 C20 C C13 N N N 0 -1.852 -1.138 -0.312
14 C21 C C14 N N N 0 -2.504 0.197 -0.678
15 C22 C C15 N Y N 0 -4.003 0.053 -0.633
16 C23 C C16 N Y N 0 -4.694 -0.337 -1.765
17 C24 C C17 N Y N 0 -6.069 -0.47 -1.729
18 C25 C C18 N Y N 0 -6.759 -0.213 -0.555
19 C27 C C19 N Y N 0 -6.064 0.18 0.585
20 C29 C C20 N N N 0 -5.958 0.832 2.87
21 C30 C C21 N Y N 0 -4.685 0.306 0.543
22 C32 C C22 N N N 0 2.68 -2.995 0.182
23 F09 F F1 N N N 0 2.289 2.994 2.217
24 F10 F F2 N N N 0 2.9 0.858 1.684
25 F11 F F3 N N N 0 4.38 2.575 1.398
26 N03 N N1 N N N 0 4.587 -1.566 -0.221
27 N16 N N2 N N N 0 2.424 -0.734 -0.441
28 N19 N N3 N N N 0 -0.395 -0.999 -0.357
29 O01 O O1 N N N 0 4.905 -3.701 0.371
30 O26 O O2 N N N 0 -8.112 -0.343 -0.517
31 O28 O O3 N N N 0 -6.737 0.433 1.74
32 O31 O O4 N N N 0 -0.107 -3.122 0.228
33 O33 O O5 N N N 0 2.153 -4.199 0.516
34 H1 H H1 N N N 0 4.867 1.172 -0.054
35 H2 H H2 N N N 0 4.86 0.699 -1.77
36 H3 H H3 N N N 0 1.016 3.808 0.516
37 H4 H H4 N N N 0 0.185 4.143 -1.777
38 H5 H H5 N N N 0 1.226 2.934 -3.653
39 H6 H H6 N N N 0 3.105 1.398 -3.236
40 H7 H H7 N N N 0 -2.159 -1.429 0.692
41 H8 H H8 N N N 0 -2.166 -1.903 -1.023
42 H9 H H9 N N N 0 -2.19 0.961 0.033
43 H10 H H10 N N N 0 -2.197 0.487 -1.683
44 H11 H H11 N N N 0 -4.157 -0.538 -2.681
45 H12 H H12 N N N 0 -6.606 -0.774 -2.615
46 H13 H H13 N N N 0 -5.422 1.751 2.636
47 H14 H H14 N N N 0 -6.616 1.002 3.722
48 H15 H H15 N N N 0 -5.244 0.046 3.114
49 H16 H H16 N N N 0 -4.143 0.607 1.427
50 H18 H H18 N N N 0 0.004 -0.147 -0.593
51 H19 H H19 N N N 0 -8.416 -1.227 -0.269
52 H20 H H20 N N N 0 2.814 -4.88 0.7
53 H17 H H17 N N N 0 5.542 -1.401 -0.271