Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 64U

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 57


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C11 C C11 N N N 0 -5.731 0.385 0.102
2 C12 C C12 N N N 0 -5.791 -0.847 -0.804
3 C13 C C13 N N N 0 -7.206 -1.0 -1.363
4 C16 C C16 N N N 0 -8.196 -1.167 -0.208
5 C17 C C17 N N N 0 -8.136 0.064 0.697
6 C18 C C18 N N N 0 -6.72 0.218 1.257
7 N N N N N N 0 -3.679 2.141 -1.078
8 C15 C C15 R N N 0 -3.344 0.841 -0.483
9 C1 C C1 N N N 0 -4.315 0.539 0.661
10 C14 C C14 N N N 0 -1.936 0.88 0.051
11 O32 O O32 N N N 0 -1.405 1.946 0.282
12 N1 N N1 N N N 0 -1.266 -0.268 0.271
13 C5 C C5 S N N 0 0.105 -0.375 0.792
14 C7 C C7 N N N 0 1.067 0.295 -0.155
15 O22 O O22 N N N 0 0.655 0.815 -1.171
16 C2 C C2 N N N 0 0.438 -1.878 0.902
17 C3 C C3 N N N 0 -0.963 -2.54 0.972
18 C4 C C4 N N N 0 -1.788 -1.627 0.034
19 N23 N N23 N N N 0 2.385 0.318 0.127
20 C24 C C24 N N N 0 3.32 0.969 -0.794
21 C25 C C25 N Y N 0 4.721 0.855 -0.251
22 C26 C C26 N Y N 0 5.219 1.834 0.589
23 C27 C C27 N Y N 0 6.503 1.73 1.088
24 C28 C C28 N Y N 0 7.292 0.647 0.746
25 C29 C C29 N Y N 0 6.795 -0.333 -0.095
26 C30 C C30 N Y N 0 5.506 -0.231 -0.588
27 CL21 CL CL21 N N N 0 7.784 -1.693 -0.524
28 H11 H H11 N N N 0 -5.992 1.273 -0.475
29 H12 H H12 N N N 0 -5.086 -0.728 -1.627
30 H12A H H12A N N N 0 -5.529 -1.734 -0.227
31 H13 H H13 N N N 0 -7.467 -0.113 -1.939
32 H13A H H13A N N N 0 -7.249 -1.878 -2.008
33 H16 H H16 N N N 0 -9.204 -1.277 -0.606
34 H16A H H16A N N N 0 -7.935 -2.055 0.368
35 H17 H H17 N N N 0 -8.397 0.952 0.121
36 H17A H H17A N N N 0 -8.84 -0.055 1.52
37 H18 H H18 N N N 0 -6.459 -0.67 1.833
38 H18A H H18A N N N 0 -6.677 1.096 1.902
39 HN H HN N N N 0 -4.583 2.112 -1.527
40 HNA H HNA N N N 0 -3.642 2.875 -0.387
41 H15 H H15 N N N 0 -3.424 0.062 -1.242
42 H1 H H1 N N N 0 -4.295 1.357 1.38
43 H1A H H1A N N N 0 -4.017 -0.386 1.155
44 H5 H H5 N N N 0 0.165 0.094 1.774
45 H2 H H2 N N N 0 0.982 -2.217 0.021
46 H4 H H4 N N N 0 -2.847 -1.676 0.291
47 H2A H H2A N N N 0 1.009 -2.081 1.808
48 H3 H H3 N N N 0 -0.932 -3.562 0.595
49 H3A H H3A N N N 0 -1.359 -2.512 1.987
50 H4A H H4A N N N 0 -1.635 -1.916 -1.005
51 HN23 H HN23 N N N 0 2.714 -0.098 0.939
52 H24 H H24 N N N 0 3.267 0.484 -1.769
53 H24A H H24A N N N 0 3.055 2.021 -0.897
54 H26 H H26 N N N 0 4.603 2.68 0.856
55 H27 H H27 N N N 0 6.892 2.494 1.744
56 H28 H H28 N N N 0 8.296 0.566 1.135
57 H30 H H30 N N N 0 5.115 -0.998 -1.241