Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : WEP

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 144


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C5 C C1 N Y N 0 21.203 3.898 1.169
2 C11 C C2 N Y N 0 16.692 0.233 -0.548
3 C7 C C3 N Y N 0 17.868 2.286 -0.134
4 C8 C C4 N Y N 0 16.703 3.003 -0.409
5 C9 C C5 N Y N 0 15.548 2.332 -0.756
6 C10 C C6 N Y N 0 15.541 0.95 -0.82
7 C12 C C7 N Y N 0 17.855 0.892 -0.206
8 C13 C C8 N N N 0 14.273 0.223 -1.187
9 C3 C C9 N Y N 0 19.109 2.999 0.238
10 C1 C C10 N N N 0 18.995 4.691 -1.614
11 C15 C C11 N N N 0 12.333 -0.724 -0.058
12 C17 C C12 S N N 0 11.548 -1.029 1.192
13 C19 C C13 N N N 0 12.374 -1.944 2.12
14 C2 C C14 N Y N 0 19.633 4.068 -0.399
15 C20 C C15 R N N 0 11.826 -3.358 1.79
16 C22 C C16 N N N 0 10.328 -3.059 1.531
17 C24 C C17 N N N 0 9.34 -1.301 0.035
18 C26 C C18 S N N 0 8.186 -2.199 -0.329
19 C28 C C19 N N N 0 8.48 -2.892 -1.66
20 C29 C C20 N N N 0 9.752 -3.733 -1.528
21 C30 C C21 N N N 0 7.306 -3.8 -2.033
22 C31 C C22 N N N 0 8.677 -1.839 -2.752
23 C33 C C23 N N N 0 5.76 -1.974 -0.272
24 C35 C C24 N N N 0 4.505 -1.151 -0.401
25 C36 C C25 N N N 0 3.284 -2.039 -0.149
26 C37 C C26 N N N 0 2.01 -1.204 -0.28
27 C38 C C27 N N N 0 0.79 -2.092 -0.028
28 C39 C C28 N N N 0 -0.485 -1.256 -0.159
29 C40 C C29 N N N 0 -1.705 -2.144 0.094
30 C41 C C30 N N N 0 -2.98 -1.309 -0.037
31 C42 C C31 N N N 0 -4.2 -2.197 0.215
32 C43 C C32 N N N 0 -5.475 -1.361 0.084
33 C44 C C33 N N N 0 -6.695 -2.249 0.336
34 C46 C C34 N N N 0 -9.121 -2.025 0.393
35 C48 C C35 N Y N 0 -10.351 -1.219 0.266
36 C49 C C36 N Y N 0 -10.276 0.102 -0.157
37 C50 C C37 N Y N 0 -11.431 0.89 -0.286
38 C51 C C38 N Y N 0 -12.64 0.337 0.09
39 C52 C C39 N Y N 0 -12.722 -1.008 0.482
40 C53 C C40 N Y N 0 -11.593 -1.786 0.567
41 C54 C C41 N N N 0 -11.691 -3.229 0.991
42 C58 C C42 N N N 0 -11.907 -5.94 0.253
43 C59 C C43 N N N 0 -13.868 1.141 0.25
44 C60 C C44 N N N 0 -14.877 0.722 1.069
45 C62 C C45 N N N 0 -16.251 2.64 0.653
46 C64 C C46 N Y N 0 -15.294 3.117 -0.265
47 C65 C C47 N Y N 0 -14.097 2.398 -0.465
48 C66 C C48 N Y N 0 -13.36 3.076 -1.425
49 C67 C C49 N Y N 0 -14.086 4.155 -1.809
50 C70 C C50 N N N 0 -11.984 2.727 -1.942
51 C72 C C51 N Y N 0 -10.077 2.837 -0.437
52 C73 C C52 N Y N 0 -10.188 3.645 0.692
53 C74 C C53 N Y N 0 -9.079 4.352 1.126
54 C75 C C54 N Y N 0 -7.892 4.225 0.413
55 C76 C C55 N Y N 0 -7.855 3.404 -0.699
56 N23 N N2 N N N 0 10.317 -1.754 0.845
57 C80 C C56 N N N 0 -17.018 0.933 2.18
58 F78 F F1 N N N 0 -6.787 4.897 0.802
59 F79 F F2 N N N 0 -11.362 3.739 1.355
60 N14 N N1 N N N 0 13.51 -0.073 0.028
61 N61 N N6 N N N 0 -16.006 1.456 1.26
62 N32 N N3 N N N 0 6.965 -1.398 -0.454
63 N45 N N4 N N N 0 -7.916 -1.449 0.211
64 N6 N N5 N Y N 0 20.748 4.519 0.132
65 N68 N N7 N Y N 0 -15.253 4.194 -1.099
66 N71 N N8 N N N 0 -11.185 2.121 -0.884
67 N77 N N9 N Y N 0 -8.931 2.747 -1.091
68 O16 O O1 N N N 0 11.905 -1.064 -1.14
69 O25 O O2 N N N 0 9.389 -0.17 -0.4
70 O34 O O3 N N N 0 5.687 -3.155 -0.005
71 O47 O O4 N N N 0 -9.195 -3.209 0.661
72 O56 O O5 N N N 0 -13.022 -4.005 -1.149
73 O57 O O6 N N N 0 -10.578 -4.186 -1.199
74 O63 O O7 N N N 0 -17.267 3.273 0.892
75 O81 O O8 N N N 0 11.988 -4.242 2.901
76 S4 S S1 N Y N 0 20.175 2.596 1.581
77 S55 S S2 N N N 0 -11.8 -4.284 -0.481
78 H1 H H1 N N N 0 22.107 4.161 1.697
79 H2 H H2 N N N 0 16.68 -0.846 -0.6
80 H3 H H3 N N N 0 16.706 4.082 -0.355
81 H4 H H4 N N N 0 14.646 2.886 -0.969
82 H5 H H5 N N N 0 18.753 0.331 0.007
83 H6 H H6 N N N 0 13.674 0.849 -1.849
84 H7 H H7 N N N 0 14.523 -0.709 -1.696
85 H8 H H8 N N N 0 18.36 5.522 -1.305
86 H9 H H9 N N N 0 19.772 5.057 -2.285
87 H10 H H10 N N N 0 18.392 3.945 -2.13
88 H18 H H11 N N N 0 11.301 -0.102 1.71
89 H11 H H12 N N N 0 13.436 -1.877 1.883
90 H12 H H13 N N N 0 12.194 -1.696 3.166
91 H21 H H14 N N N 0 12.304 -3.764 0.898
92 H13 H H15 N N N 0 9.893 -3.827 0.892
93 H14 H H16 N N N 0 9.785 -2.999 2.474
94 H27 H H17 N N N 0 8.05 -2.949 0.45
95 H15 H H18 N N N 0 10.57 -3.102 -1.181
96 H16 H H19 N N N 0 9.583 -4.536 -0.811
97 H17 H H20 N N N 0 10.008 -4.159 -2.497
98 H19 H H21 N N N 0 7.166 -4.55 -1.255
99 H20 H H22 N N N 0 6.4 -3.201 -2.128
100 H22 H H23 N N N 0 7.515 -4.294 -2.982
101 H23 H H24 N N N 0 8.886 -2.333 -3.701
102 H24 H H25 N N N 0 7.771 -1.24 -2.847
103 H25 H H26 N N N 0 9.513 -1.192 -2.487
104 H26 H H27 N N N 0 4.523 -0.343 0.33
105 H28 H H28 N N N 0 4.447 -0.732 -1.406
106 H29 H H29 N N N 0 3.266 -2.848 -0.88
107 H30 H H30 N N N 0 3.342 -2.459 0.855
108 H31 H H31 N N N 0 2.028 -0.396 0.451
109 H32 H H32 N N N 0 1.952 -0.784 -1.284
110 H33 H H33 N N N 0 0.771 -2.9 -0.759
111 H34 H H34 N N N 0 0.847 -2.512 0.976
112 H35 H H35 N N N 0 -0.467 -0.448 0.572
113 H36 H H36 N N N 0 -0.543 -0.836 -1.163
114 H37 H H37 N N N 0 -1.724 -2.953 -0.637
115 H38 H H38 N N N 0 -1.648 -2.564 1.098
116 H39 H H39 N N N 0 -2.962 -0.501 0.694
117 H40 H H40 N N N 0 -3.038 -0.889 -1.042
118 H41 H H41 N N N 0 -4.219 -3.005 -0.516
119 H42 H H42 N N N 0 -4.143 -2.617 1.219
120 H43 H H43 N N N 0 -5.457 -0.553 0.815
121 H44 H H44 N N N 0 -5.533 -0.941 -0.92
122 H45 H H45 N N N 0 -6.714 -3.057 -0.395
123 H46 H H46 N N N 0 -6.638 -2.669 1.341
124 H47 H H47 N N N 0 -9.313 0.531 -0.391
125 H48 H H48 N N N 0 -13.684 -1.438 0.717
126 H49 H H49 N N N 0 -10.807 -3.499 1.567
127 H50 H H50 N N N 0 -12.581 -3.368 1.604
128 H51 H H51 N N N 0 -11.978 -6.685 -0.539
129 H52 H H52 N N N 0 -11.016 -6.13 0.852
130 H53 H H53 N N N 0 -12.791 -5.999 0.888
131 H54 H H54 N N N 0 -14.775 -0.224 1.58
132 H55 H H55 N N N 0 -13.788 4.872 -2.559
133 H56 H H56 N N N 0 -12.078 2.028 -2.773
134 H57 H H57 N N N 0 -11.489 3.634 -2.291
135 H61 H H61 N N N 0 -17.368 -0.036 1.823
136 H58 H H58 N N N 0 -9.134 4.987 1.998
137 H59 H H59 N N N 0 -6.936 3.302 -1.256
138 H60 H H60 N N N 0 -17.858 1.626 2.229
139 H62 H H62 N N N 0 -16.583 0.819 3.173
140 H63 H H63 N N N 0 13.853 0.198 0.894
141 H64 H H64 N N N 0 7.024 -0.454 -0.668
142 H65 H H65 N N N 0 -7.857 -0.505 -0.003
143 H69 H H66 N N N 0 -15.939 4.875 -1.177
144 H66 H H67 N N N 0 11.66 -5.138 2.741