Chemical Components in the PDB

pdbe.org/chem
wwPDB
EMDataBank
spacer

PDBeChem : Atoms of Molecule

 Molecule : 21G

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 48


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N Y N 0 4.499 -0.598 0.106
2 C2 C C2 N Y N 0 5.829 -0.214 0.142
3 C3 C C3 N Y N 0 6.156 1.122 -0.043
4 C5 C C4 N Y N 0 3.942 1.722 -0.3
5 C6 C C5 N Y N 0 3.538 0.388 -0.121
6 C7 C C6 N Y N 0 2.071 0.385 -0.234
7 N4 N N1 N Y N 0 5.23 2.034 -0.25
8 C8 C C7 N Y N 0 1.7 1.67 -0.464
9 N9 N N2 N Y N 0 2.803 2.468 -0.505
10 C11 C C8 N Y N 0 1.177 -0.787 -0.119
11 N12 N N3 N Y N 0 1.704 -1.982 0.115
12 C13 C C9 N Y N 0 0.935 -3.056 0.225
13 C14 C C10 N Y N 0 -0.435 -2.923 0.094
14 C15 C C11 N Y N 0 -0.962 -1.65 -0.153
15 N16 N N4 N Y N 0 -0.134 -0.617 -0.246
16 N17 N N5 N N N 0 -2.33 -1.47 -0.292
17 C18 C C12 S N N 0 -2.87 -0.133 -0.549
18 C20 C C13 S N N 0 -3.056 0.606 0.777
19 C22 C C14 N N N 0 -4.53 0.976 0.953
20 C23 C C15 N N N 0 -4.971 1.879 -0.201
21 C24 C C16 N N N 0 -4.785 1.14 -1.527
22 C25 C C17 N N N 0 -4.221 -0.256 -1.258
23 C26 C C18 N N N 0 -5.193 -1.037 -0.371
24 C27 C C19 N N N 0 -5.379 -0.298 0.955
25 C28 C C20 N N N 0 -2.221 1.861 0.775
26 O29 O O1 N N N 0 -0.889 1.779 0.633
27 O30 O O2 N N N 0 -2.75 2.939 0.9
28 F31 F F1 N N N 0 -1.247 -3.998 0.2
29 F32 F F2 N N N 0 6.798 -1.131 0.354
30 H1 H H1 N N N 0 4.214 -1.63 0.246
31 H2 H H2 N N N 0 7.194 1.42 -0.015
32 H3 H H3 N N N 0 0.683 2.009 -0.596
33 H4 H H4 N N N 0 2.789 3.427 -0.656
34 H5 H H5 N N N 0 1.374 -4.024 0.415
35 H6 H H6 N N N 0 -2.929 -2.229 -0.219
36 H7 H H7 N N N 0 -2.178 0.423 -1.181
37 H8 H H8 N N N 0 -2.743 -0.038 1.599
38 H9 H H9 N N N 0 -4.663 1.502 1.898
39 H10 H H10 N N N 0 -6.021 2.143 -0.075
40 H11 H H11 N N N 0 -4.367 2.787 -0.202
41 H12 H H12 N N N 0 -5.747 1.052 -2.032
42 H13 H H13 N N N 0 -4.092 1.696 -2.159
43 H14 H H14 N N N 0 -4.088 -0.783 -2.203
44 H15 H H15 N N N 0 -6.155 -1.125 -0.876
45 H16 H H16 N N N 0 -4.791 -2.032 -0.18
46 H17 H H17 N N N 0 -5.065 -0.942 1.777
47 H18 H H18 N N N 0 -6.429 -0.035 1.081
48 H19 H H19 N N N 0 -0.395 2.611 0.637