Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : WTT

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 68


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N N N 0 11.767 -0.022 -0.366
2 C2 C C2 N N N 0 10.238 -0.015 -0.428
3 C3 C C3 N N N 0 9.692 -1.234 0.318
4 C7 C C4 N Y N 0 5.389 0.105 2.017
5 C8 C C5 N Y N 0 4.01 0.112 1.967
6 C9 C C6 N Y N 0 3.36 0.064 0.735
7 C10 C C7 N Y N 0 1.877 0.071 0.675
8 C11 C C8 N Y N 0 1.225 1.119 0.105
9 C12 C C9 N Y N 0 -1.019 2.046 -0.462
10 C13 C C10 N Y N 0 -2.273 1.549 -0.251
11 C14 C C11 N N N 0 -3.539 2.201 -0.638
12 C15 C C12 N N N 0 -5.973 2.248 -0.754
13 C16 C C13 N Y N 0 -7.132 1.376 -0.345
14 C19 C C14 N Y N 0 -9.26 -0.224 0.406
15 C20 C C15 N N N 0 -10.761 -1.973 -0.178
16 C21 C C16 N Y N 0 -8.766 0.731 1.282
17 N N N1 N Y N 0 -0.138 1.137 0.043
18 C C C17 N N N 0 12.295 -1.218 -1.115
19 N1 N N2 N N N 0 -4.716 1.6 -0.37
20 N2 N N3 N Y N 0 -2.155 0.361 0.37
21 C4 C C18 N N N 0 8.163 -1.227 0.256
22 C5 C C19 N N N 0 7.632 0.051 0.909
23 C6 C C20 N Y N 0 6.126 0.057 0.847
24 O O O1 N N N 0 13.618 -1.43 -1.195
25 C17 C C21 N Y N 0 -7.619 0.421 -1.219
26 C18 C C22 N Y N 0 -8.682 -0.379 -0.846
27 O1 O O2 N N N 0 -10.305 -1.011 0.775
28 C22 C C23 N Y N 0 -7.704 1.529 0.904
29 C23 C C24 N Y N 0 -0.873 0.097 0.556
30 C24 C C25 N Y N 0 -0.212 -1.002 1.151
31 C25 C C26 N Y N 0 1.143 -1.017 1.205
32 C26 C C27 N Y N 0 4.107 0.009 -0.44
33 C27 C C28 N Y N 0 5.486 0.014 -0.378
34 C28 C C29 N N N 0 8.178 1.269 0.162
35 C29 C C30 N N N 0 9.707 1.263 0.224
36 F F F1 N N N 0 -11.834 -2.691 0.361
37 F1 F F2 N N N 0 -11.177 -1.316 -1.341
38 F2 F F3 N N N 0 -9.719 -2.853 -0.487
39 O2 O O3 N N N 0 -3.521 3.28 -1.198
40 O3 O O4 N N N 0 11.527 -1.986 -1.645
41 H1 H H1 N N N 0 12.153 0.891 -0.82
42 H2 H H2 N N N 0 12.088 -0.074 0.674
43 H3 H H3 N N N 0 9.917 -0.053 -1.469
44 H4 H H4 N N N 0 10.071 -2.144 -0.146
45 H5 H H5 N N N 0 10.013 -1.197 1.359
46 H6 H H6 N N N 0 5.894 0.143 2.971
47 H7 H H7 N N N 0 3.435 0.153 2.88
48 H8 H H8 N N N 0 1.791 1.944 -0.302
49 H9 H H9 N N N 0 -0.772 2.983 -0.939
50 H10 H H10 N N N 0 -5.991 2.394 -1.834
51 H11 H H11 N N N 0 -6.051 3.214 -0.256
52 H12 H H12 N N N 0 -9.212 0.851 2.258
53 H13 H H13 N N N 0 -4.731 0.739 0.076
54 H14 H H14 N N N 0 7.842 -1.265 -0.785
55 H15 H H15 N N N 0 7.774 -2.096 0.788
56 H16 H H16 N N N 0 7.953 0.088 1.949
57 H17 H H17 N N N 0 13.909 -2.21 -1.686
58 H18 H H18 N N N 0 -7.169 0.301 -2.193
59 H19 H H19 N N N 0 -9.062 -1.125 -1.528
60 H20 H H20 N N N 0 -7.319 2.273 1.586
61 H21 H H21 N N N 0 -0.782 -1.824 1.557
62 H22 H H22 N N N 0 1.659 -1.853 1.654
63 H23 H H23 N N N 0 3.609 -0.028 -1.397
64 H24 H H24 N N N 0 6.066 -0.024 -1.288
65 H25 H H25 N N N 0 7.856 1.232 -0.879
66 H26 H H26 N N N 0 7.799 2.18 0.627
67 H27 H H27 N N N 0 10.028 1.3 1.265
68 H28 H H28 N N N 0 10.095 2.131 -0.308