Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 9F1

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 65


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N14 N N1 N Y N 0 -0.266 -0.537 -1.032
2 C13 C C1 N Y N 0 -1.175 0.39 -0.69
3 C18 C C2 N N N 0 -0.921 -3.769 1.27
4 C17 C C3 R N N 0 0.456 -4.171 0.748
5 C16 C C4 N N N 0 1.66 -2.753 -0.82
6 C19 C C5 N N N 0 -1.295 -2.395 0.779
7 C21 C C6 N N N 0 -7.466 0.841 0.477
8 C24 C C7 N N N 0 -9.683 1.681 0.199
9 C12 C C8 N Y N 0 -0.602 1.619 -0.875
10 C27 C C9 N N N 0 0.663 -3.577 -0.621
11 C33 C C10 N Y N 0 6.271 0.462 -0.32
12 CL1 CL CL1 N N N 0 -1.334 3.162 -0.564
13 C2 C C11 S N N 0 2.075 -0.608 -1.962
14 C3 C C12 N Y N 0 0.82 0.049 -1.451
15 C4 C C13 N N N 0 1.84 -2.104 -2.168
16 C5 C C14 N Y N 0 -2.568 0.213 -0.213
17 C6 C C15 N Y N 0 -3.333 1.376 -0.042
18 C7 C C16 N Y N 0 -4.647 1.294 0.358
19 C8 C C17 N Y N 0 -5.225 0.052 0.594
20 C9 C C18 N Y N 0 -4.474 -1.101 0.452
21 C10 C C19 N Y N 0 -3.13 -1.029 0.072
22 N11 N N2 N Y N 0 0.656 1.396 -1.35
23 N15 N N3 N N N 0 -2.437 -2.241 0.076
24 N20 N N4 N N N 0 -6.569 -0.032 0.975
25 O22 O O1 N N N 0 -8.773 0.704 0.77
26 O23 O O2 N N N 0 -7.096 1.753 -0.237
27 O25 O O3 N N N 0 -0.582 -1.441 1.011
28 C26 C C20 N N N 0 0.544 -5.696 0.661
29 C28 C C21 N Y N 0 7.282 0.645 0.604
30 C29 C C22 N Y N 0 7.015 1.257 1.815
31 C30 C C23 N Y N 0 5.736 1.69 2.113
32 C31 C C24 N Y N 0 4.713 1.515 1.2
33 C32 C C25 N Y N 0 4.975 0.902 -0.03
34 F34 F F1 N N N 0 6.534 -0.136 -1.503
35 C35 C C26 N N N 0 3.889 0.711 -1.01
36 F36 F F2 N N N 0 3.464 1.939 1.493
37 N37 N N5 N N N 0 3.153 -0.418 -0.989
38 O38 O O4 N N N 0 3.658 1.572 -1.836
39 C39 C C27 N N N 0 8.125 1.451 2.816
40 H50 H H2 N N N 0 -1.661 -4.489 0.922
41 H51 H H3 N N N 0 -0.905 -3.769 2.36
42 H49 H H4 N N N 0 1.225 -3.8 1.426
43 H48 H H5 N N N 0 2.339 -2.517 -0.014
44 H53 H H6 N N N 0 -9.621 1.642 -0.889
45 H54 H H7 N N N 0 -10.702 1.455 0.513
46 H55 H H8 N N N 0 -9.409 2.678 0.543
47 H59 H H9 N N N 0 -0.011 -3.827 -1.427
48 H40 H H10 N N N 0 2.361 -0.153 -2.911
49 H41 H H11 N N N 0 2.7 -2.543 -2.674
50 H42 H H12 N N N 0 0.943 -2.254 -2.769
51 H43 H H13 N N N 0 -2.888 2.343 -0.226
52 H44 H H14 N N N 0 -5.23 2.194 0.489
53 H45 H H15 N N N 0 -4.929 -2.064 0.637
54 H46 H H16 N N N 0 1.314 2.073 -1.575
55 H47 H H17 N N N 0 -2.783 -2.988 -0.437
56 H52 H H18 N N N 0 -6.854 -0.718 1.598
57 H57 H H19 N N N 0 -0.224 -6.067 -0.017
58 H58 H H20 N N N 0 1.527 -5.983 0.289
59 H56 H H21 N N N 0 0.391 -6.126 1.652
60 H60 H H22 N N N 0 8.284 0.309 0.379
61 H61 H H23 N N N 0 5.536 2.163 3.063
62 H62 H H24 N N N 0 3.338 -1.105 -0.33
63 H64 H H25 N N N 0 8.606 2.414 2.643
64 H63 H H26 N N N 0 7.712 1.428 3.825
65 H65 H H27 N N N 0 8.858 0.653 2.706