Chemical Components in the PDB

pdbe.org/chem
wwPDB
EMDataBank
spacer

PDBeChem : Atoms of Molecule

 Molecule : A1ANW

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 N1 N N1 N Y N 0 -1.398 -2.709 0.654
2 N3 N N2 N Y N 0 -4.994 -0.845 0.914
3 C4 C C1 N Y N 0 -1.564 -1.47 0.2
4 C5 C C2 N Y N 0 -2.399 -3.372 1.205
5 C6 C C3 N Y N 0 -3.871 -1.628 0.914
6 C7 C C4 N Y N 0 -4.714 0.378 0.341
7 C8 C C5 N N N 0 -5.676 1.478 0.169
8 C10 C C6 N N N 0 -6.804 3.484 0.295
9 C13 C C7 N Y N 0 -2.835 -0.881 0.32
10 C15 C C8 N Y N 0 1.657 0.809 -1.282
11 C17 C C9 N Y N 0 3.849 1.606 -0.668
12 C20 C C10 N N N 0 6.671 1.452 0.33
13 C21 C C11 N N N 0 5.876 2.767 0.304
14 C22 C C12 N N N 0 4.856 2.708 -0.819
15 O2 O O1 N N N 0 5.97 -1.121 0.514
16 S S S1 N N N 0 5.547 0.164 0.949
17 O1 O O2 N N N 0 5.209 0.406 2.308
18 C16 C C13 N Y N 0 2.637 1.776 -1.336
19 C18 C C14 N Y N 0 4.049 0.457 0.061
20 C19 C C15 N Y N 0 3.06 -0.514 0.12
21 C14 C C16 N Y N 0 1.867 -0.346 -0.552
22 C3 C C17 S N N 0 0.803 -1.411 -0.491
23 C1 C C18 N N N 0 0.853 -2.256 -1.765
24 C2 C C19 N N N 0 -0.228 -3.337 -1.703
25 C C C20 N N N 0 0.609 -1.36 -2.981
26 N N N3 N N N 0 -0.514 -0.779 -0.375
27 N2 N N4 N Y N 0 -3.604 -2.862 1.338
28 C12 C C21 N Y N 0 -3.409 0.41 -0.04
29 C11 C C22 N N N 0 -6.91 1.449 -0.706
30 O O O3 N N N 0 -7.739 2.534 -0.249
31 C9 C C23 N N N 0 -5.617 2.671 0.76
32 H1 H H1 N N N 0 -5.858 -1.111 1.265
33 H10 H H2 N N N 0 -2.22 -4.376 1.56
34 H13 H H3 N N N 0 -6.499 4.194 -0.474
35 H12 H H4 N N N 0 -7.25 4.011 1.137
36 H17 H H5 N N N 0 0.723 0.956 -1.805
37 H20 H H6 N N N 0 7.006 1.201 -0.677
38 H21 H H7 N N N 0 7.529 1.548 0.995
39 H22 H H9 N N N 0 6.557 3.601 0.136
40 H23 H H8 N N N 0 5.363 2.901 1.256
41 H24 H H10 N N N 0 5.384 2.569 -1.762
42 H25 H H11 N N N 0 4.326 3.66 -0.858
43 H18 H H12 N N N 0 2.464 2.677 -1.905
44 H19 H H13 N N N 0 3.23 -1.417 0.689
45 H H H14 N N N 0 0.977 -2.049 0.375
46 H5 H H15 N N N 0 1.833 -2.726 -1.851
47 H7 H H16 N N N 0 -0.192 -3.939 -2.611
48 H6 H H17 N N N 0 -0.054 -3.975 -0.837
49 H8 H H18 N N N 0 -1.207 -2.867 -1.617
50 H3 H H19 N N N 0 1.379 -0.59 -3.026
51 H4 H H20 N N N 0 0.645 -1.962 -3.889
52 H2 H H21 N N N 0 -0.371 -0.89 -2.895
53 H9 H H22 N N N 0 -0.649 0.124 -0.703
54 H16 H H23 N N N 0 -2.896 1.232 -0.517
55 H15 H H24 N N N 0 -6.634 1.6 -1.749
56 H14 H H25 N N N 0 -7.432 0.5 -0.588
57 H11 H H26 N N N 0 -4.854 2.999 1.45