Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 7S6

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 86


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 -3.652 2.83 1.274
2 C1 C C1 N N N 0 -3.263 2.029 0.451
3 C2 C C2 R N N 0 -4.25 1.35 -0.463
4 N1 N N1 N N N 0 -5.53 2.082 -0.472
5 C3 C C3 N N N 0 -5.669 3.421 -0.417
6 C4 C C4 N N N 0 -7.038 4.042 -0.524
7 C5 C C5 N N N 0 -7.605 4.27 0.879
8 C6 C C6 N N N 0 -6.935 5.381 -1.257
9 O2 O O2 N N N 0 -4.692 4.127 -0.282
10 C7 C C7 N N N 0 -6.629 1.109 -0.55
11 C8 C C8 R N N 0 -5.995 -0.299 -0.565
12 N2 N N2 N N N 0 -6.785 -1.231 0.243
13 C9 C C9 N N N 0 -7.828 -1.883 -0.307
14 C10 C C10 S N N 0 -8.64 -2.842 0.524
15 N3 N N3 N N N 0 -9.925 -3.156 -0.153
16 C11 C C11 N N N 0 -10.347 -4.448 0.446
17 C12 C C12 S N N 0 -9.041 -5.258 0.586
18 F1 F F1 N N N 0 -8.868 -6.097 -0.52
19 C13 C C13 N N N 0 -7.918 -4.202 0.637
20 O3 O O3 N N N 0 -8.114 -1.697 -1.471
21 C14 C C14 N N N 0 -4.6 -0.06 0.075
22 N4 N N4 N N N 0 -1.949 1.75 0.35
23 C15 C C15 N N N 0 -0.988 2.415 1.235
24 C16 C C16 N Y N 0 0.403 1.931 0.92
25 C17 C C17 N Y N 0 1.166 2.595 -0.026
26 C18 C C18 N Y N 0 2.44 2.158 -0.319
27 C19 C C19 N Y N 0 2.962 1.042 0.341
28 C20 C C20 N N N 0 4.285 0.582 0.041
29 C21 C C21 N N N 0 5.369 0.205 -0.204
30 C22 C C22 N Y N 0 6.692 -0.255 -0.503
31 C23 C C23 N Y N 0 7.469 0.414 -1.453
32 C24 C C24 N Y N 0 8.743 -0.034 -1.735
33 C25 C C25 N Y N 0 9.251 -1.143 -1.081
34 C26 C C26 N N N 0 10.643 -1.627 -1.396
35 N5 N N5 N N N 0 11.604 -0.964 -0.504
36 C27 C C27 N N N 0 12.986 -1.226 -0.932
37 C28 C C28 N N N 0 13.951 -0.471 -0.014
38 O4 O O4 N N N 0 13.719 -0.866 1.341
39 C29 C C29 N N N 0 12.383 -0.625 1.791
40 C30 C C30 N N N 0 11.403 -1.382 0.891
41 C31 C C31 N Y N 0 8.487 -1.81 -0.14
42 C32 C C32 N Y N 0 7.213 -1.37 0.157
43 C33 C C33 N Y N 0 2.187 0.377 1.295
44 C34 C C34 N Y N 0 0.915 0.829 1.582
45 H4 H H4 N N N 0 -7.599 3.33 1.431
46 H1 H H1 N N N 0 -3.845 1.281 -1.473
47 H2 H H2 N N N 0 -7.697 3.374 -1.078
48 H3 H H3 N N N 0 -8.628 4.639 0.802
49 H5 H H5 N N N 0 -6.993 5.003 1.403
50 H6 H H6 N N N 0 -6.531 5.218 -2.256
51 H7 H H7 N N N 0 -7.926 5.829 -1.334
52 H8 H H8 N N N 0 -6.276 6.049 -0.702
53 H9 H H9 N N N 0 -7.279 1.213 0.318
54 H10 H H10 N N N 0 -7.202 1.269 -1.464
55 H11 H H11 N N N 0 -5.892 -0.664 -1.587
56 H12 H H12 N N N 0 -6.556 -1.38 1.174
57 H13 H H13 N N N 0 -8.823 -2.425 1.515
58 H14 H H14 N N N 0 -10.61 -2.436 0.019
59 H16 H H16 N N N 0 -10.799 -4.283 1.424
60 H17 H H17 N N N 0 -11.045 -4.963 -0.214
61 H18 H H18 N N N 0 -9.054 -5.843 1.505
62 H19 H H19 N N N 0 -7.232 -4.337 -0.199
63 H20 H H20 N N N 0 -7.38 -4.267 1.583
64 H21 H H21 N N N 0 -3.881 -0.803 -0.27
65 H22 H H22 N N N 0 -4.665 -0.057 1.163
66 H26 H H26 N N N 0 0.761 3.457 -0.535
67 H23 H H23 N N N 0 -1.638 1.109 -0.308
68 H24 H H24 N N N 0 -1.041 3.493 1.083
69 H25 H H25 N N N 0 -1.228 2.182 2.272
70 H27 H H27 N N N 0 3.033 2.676 -1.058
71 H28 H H28 N N N 0 7.074 1.279 -1.964
72 H29 H H29 N N N 0 9.345 0.481 -2.469
73 H30 H H30 N N N 0 10.695 -2.705 -1.249
74 H31 H H31 N N N 0 10.884 -1.389 -2.432
75 H33 H H33 N N N 0 13.189 -2.295 -0.873
76 H34 H H34 N N N 0 13.12 -0.886 -1.959
77 H35 H H35 N N N 0 14.978 -0.707 -0.292
78 H36 H H36 N N N 0 13.784 0.602 -0.114
79 H37 H H37 N N N 0 12.277 -0.973 2.818
80 H38 H H38 N N N 0 12.171 0.443 1.744
81 H39 H H39 N N N 0 10.381 -1.156 1.195
82 H40 H H40 N N N 0 11.581 -2.454 0.979
83 H41 H H41 N N N 0 8.89 -2.674 0.367
84 H42 H H42 N N N 0 6.62 -1.889 0.895
85 H43 H H43 N N N 0 2.583 -0.486 1.809
86 H44 H H44 N N N 0 0.317 0.319 2.322