Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4OA

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 67


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N N N 0 4.2 1.693 -0.642
2 C10 C C10 S N N 0 3.429 0.421 -1.003
3 C11 C C11 N N N 0 1.322 1.562 -0.283
4 C12 C C12 N N N 0 0.013 1.446 0.516
5 C13 C C13 R N N 0 -0.704 0.202 0.029
6 C14 C C14 S N N 0 0.183 -1.019 0.394
7 C15 C C15 N N N 0 -0.776 -2.186 0.135
8 C16 C C16 N N N 0 -2.12 -1.668 0.717
9 C17 C C17 R N N 0 -2.037 -0.121 0.695
10 C18 C C18 N N N 0 -0.887 0.272 -1.488
11 C19 C C19 N N N 0 3.012 0.477 -2.474
12 O1B O O1B N N N 0 5.883 0.367 2.444
13 C2 C C2 N N N 0 4.61 1.639 0.831
14 C20 C C20 R N N 0 -3.193 0.46 -0.123
15 C21 C C21 N N N 0 -3.119 1.988 -0.096
16 C22 C C22 N N N 0 -4.523 0.003 0.479
17 C23 C C23 N N N 0 -5.675 0.48 -0.409
18 C24 C C24 N N N 0 -6.985 0.03 0.184
19 C3 C C3 R N N 0 5.501 0.418 1.068
20 C4 C C4 N N N 0 4.732 -0.854 0.704
21 O4 O O4 N N N 0 -8.139 0.337 -0.429
22 O4A O O4A N N N 0 -6.997 -0.606 1.211
23 C5 C C5 R N N 0 4.323 -0.799 -0.769
24 C6 C C6 N N N 0 3.553 -2.071 -1.131
25 C7 C C7 N N N 0 2.301 -2.178 -0.258
26 C8 C C8 R N N 0 1.409 -0.959 -0.498
27 C9 C C9 S N N 0 2.183 0.314 -0.123
28 H1 H H1 N N N 0 5.092 1.766 -1.265
29 H1A H H1A N N N 0 3.566 2.563 -0.812
30 H11 H H11 N N N 0 1.085 1.699 -1.338
31 H11A H H11A N N N 0 1.88 2.428 0.071
32 H12 H H12 N N N 0 0.235 1.354 1.579
33 H12A H H12A N N N 0 -0.608 2.325 0.341
34 H14 H H14 N N N 0 0.464 -0.985 1.447
35 H15 H H15 N N N 0 -0.868 -2.381 -0.933
36 H15A H H15A N N N 0 -0.447 -3.081 0.664
37 H16 H H16 N N N 0 -2.951 -2.007 0.098
38 H16A H H16A N N N 0 -2.246 -2.022 1.74
39 H17 H H17 N N N 0 -2.057 0.273 1.711
40 H18 H H18 N N N 0 0.086 0.377 -1.967
41 H18A H H18A N N N 0 -1.368 -0.641 -1.839
42 H18B H H18B N N N 0 -1.51 1.13 -1.74
43 H19 H H19 N N N 0 3.901 0.553 -3.101
44 H19A H H19A N N N 0 2.463 -0.429 -2.731
45 H19B H H19B N N N 0 2.376 1.347 -2.639
46 HO1B H HO1B N N N 0 6.376 1.143 2.745
47 H2 H H2 N N N 0 5.158 2.545 1.089
48 H2A H H2A N N N 0 3.718 1.564 1.453
49 H20 H H20 N N N 0 -3.121 0.11 -1.153
50 H21 H H21 N N N 0 -3.121 2.334 0.937
51 H21A H H21A N N N 0 -2.202 2.316 -0.587
52 H21B H H21B N N N 0 -3.98 2.402 -0.62
53 H22 H H22 N N N 0 -4.54 -1.085 0.542
54 H22A H H22A N N N 0 -4.635 0.427 1.477
55 H23 H H23 N N N 0 -5.659 1.568 -0.472
56 H23A H H23A N N N 0 -5.563 0.057 -1.407
57 H3 H H3 N N N 0 6.393 0.493 0.446
58 H4 H H4 N N N 0 5.368 -1.723 0.873
59 H4A H H4A N N N 0 3.841 -0.929 1.327
60 HO4 H HO4 N N N 0 -8.955 0.027 -0.011
61 H5 H H5 N N N 0 5.214 -0.722 -1.392
62 H6 H H6 N N N 0 3.263 -2.033 -2.181
63 H6A H H6A N N N 0 4.189 -2.941 -0.961
64 H7 H H7 N N N 0 1.755 -3.085 -0.516
65 H7A H H7A N N N 0 2.592 -2.215 0.792
66 H8 H H8 N N N 0 1.102 -0.927 -1.543
67 H9 H H9 N N N 0 2.494 0.231 0.919