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PDBeChem : Atoms of Molecule
Molecule : KE1
Atoms of a chemical element, that composes a molecule
Total Number of Atoms: 53
Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
1 |
C1 |
C |
C1 |
R |
N |
N |
0 |
1.496 |
0.789 |
0.26 |
2 |
C2 |
C |
C2 |
N |
N |
N |
0 |
0.919 |
-0.544 |
-0.158 |
3 |
C3 |
C |
C3 |
N |
N |
N |
0 |
1.803 |
-1.514 |
0.144 |
4 |
C5 |
C |
C4 |
S |
N |
N |
0 |
2.87 |
0.447 |
0.863 |
5 |
C7 |
C |
C5 |
N |
N |
N |
0 |
4.043 |
0.545 |
-1.32 |
6 |
C11 |
C |
C6 |
N |
N |
N |
0 |
1.659 |
1.705 |
-0.955 |
7 |
C1A |
C |
C7 |
R |
N |
N |
0 |
-1.738 |
-0.292 |
0.444 |
8 |
C2A |
C |
C8 |
N |
N |
N |
0 |
-1.661 |
1.231 |
0.661 |
9 |
C31 |
C |
C9 |
N |
N |
N |
0 |
1.579 |
-2.886 |
-0.116 |
10 |
C4A |
C |
C10 |
N |
N |
N |
0 |
-3.215 |
-0.573 |
0.082 |
11 |
C5A |
C |
C11 |
R |
N |
N |
0 |
-3.955 |
0.657 |
0.664 |
12 |
C6 |
C |
C12 |
S |
N |
N |
0 |
3.986 |
1.129 |
0.068 |
13 |
C61 |
C |
C13 |
R |
N |
N |
0 |
5.325 |
0.902 |
0.772 |
14 |
C62 |
C |
C14 |
N |
N |
N |
0 |
6.441 |
1.583 |
-0.023 |
15 |
C6A |
C |
C15 |
N |
N |
N |
0 |
-5.259 |
0.883 |
-0.057 |
16 |
C8A |
C |
C16 |
N |
N |
N |
0 |
-7.608 |
0.363 |
-0.44 |
17 |
C9A |
C |
C17 |
N |
N |
N |
0 |
-6.248 |
-0.88 |
1.304 |
18 |
N3A |
N |
N1 |
N |
N |
N |
0 |
-3.012 |
1.775 |
0.404 |
19 |
N4 |
N |
N2 |
N |
N |
N |
0 |
2.971 |
-1.016 |
0.743 |
20 |
N7A |
N |
N3 |
N |
N |
N |
0 |
-6.34 |
0.144 |
0.26 |
21 |
O31 |
O |
O1 |
N |
N |
N |
0 |
2.467 |
-3.808 |
0.313 |
22 |
O32 |
O |
O2 |
N |
N |
N |
0 |
0.586 |
-3.236 |
-0.727 |
23 |
O62 |
O |
O3 |
N |
N |
N |
0 |
5.271 |
1.456 |
2.088 |
24 |
O6A |
O |
O4 |
N |
N |
N |
0 |
-5.335 |
1.73 |
-0.921 |
25 |
O7 |
O |
O5 |
N |
N |
N |
0 |
4.012 |
1.273 |
-2.283 |
26 |
S21 |
S |
S1 |
N |
N |
N |
0 |
-0.652 |
-0.789 |
-0.916 |
27 |
H1 |
H |
H1 |
N |
N |
N |
0 |
0.859 |
1.261 |
1.008 |
28 |
H4 |
H |
H4 |
N |
N |
N |
0 |
2.911 |
0.749 |
1.909 |
29 |
H5 |
H |
H5 |
N |
N |
N |
0 |
4.11 |
-0.525 |
-1.454 |
30 |
H7 |
H |
H7 |
N |
N |
N |
0 |
0.68 |
2.067 |
-1.271 |
31 |
H8 |
H |
H8 |
N |
N |
N |
0 |
2.291 |
2.553 |
-0.689 |
32 |
H9 |
H |
H9 |
N |
N |
N |
0 |
2.121 |
1.149 |
-1.77 |
33 |
H10 |
H |
H10 |
N |
N |
N |
0 |
-1.464 |
-0.818 |
1.358 |
34 |
H11 |
H |
H11 |
N |
N |
N |
0 |
-1.363 |
1.445 |
1.687 |
35 |
H12 |
H |
H12 |
N |
N |
N |
0 |
-0.946 |
1.669 |
-0.035 |
36 |
H13 |
H |
H13 |
N |
N |
N |
0 |
-3.344 |
-0.626 |
-0.999 |
37 |
H14 |
H |
H14 |
N |
N |
N |
0 |
-3.56 |
-1.492 |
0.558 |
38 |
H15 |
H |
H15 |
N |
N |
N |
0 |
-4.121 |
0.535 |
1.734 |
39 |
H16 |
H |
H16 |
N |
N |
N |
0 |
3.786 |
2.198 |
0.004 |
40 |
H17 |
H |
H17 |
N |
N |
N |
0 |
5.526 |
-0.168 |
0.836 |
41 |
H18 |
H |
H18 |
N |
N |
N |
0 |
6.241 |
2.653 |
-0.087 |
42 |
H19 |
H |
H19 |
N |
N |
N |
0 |
7.395 |
1.422 |
0.479 |
43 |
H20 |
H |
H20 |
N |
N |
N |
0 |
6.482 |
1.161 |
-1.027 |
44 |
H21 |
H |
H21 |
N |
N |
N |
0 |
-7.653 |
-0.279 |
-1.32 |
45 |
H22 |
H |
H22 |
N |
N |
N |
0 |
-8.438 |
0.125 |
0.226 |
46 |
H23 |
H |
H23 |
N |
N |
N |
0 |
-7.678 |
1.406 |
-0.748 |
47 |
H24 |
H |
H24 |
N |
N |
N |
0 |
-6.495 |
-0.437 |
2.269 |
48 |
H25 |
H |
H25 |
N |
N |
N |
0 |
-6.948 |
-1.686 |
1.085 |
49 |
H26 |
H |
H26 |
N |
N |
N |
0 |
-5.234 |
-1.277 |
1.335 |
50 |
H27 |
H |
H27 |
N |
N |
N |
0 |
-3.095 |
2.104 |
-0.546 |
51 |
H29 |
H |
H29 |
N |
N |
N |
0 |
3.725 |
-1.553 |
1.034 |
52 |
H31 |
H |
H31 |
N |
N |
N |
0 |
2.229 |
-4.718 |
0.088 |
53 |
H32 |
H |
H32 |
N |
N |
N |
0 |
5.096 |
2.406 |
2.108 |
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