Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4CV

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 47


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N Y N 0 0.818 1.903 -0.21
2 C13 C C2 N N N 0 -1.781 4.322 0.838
3 C15 C C3 N N N 0 -1.718 4.24 -1.555
4 C17 C C4 N Y N 0 0.736 0.512 -0.133
5 C21 C C5 N Y N 0 0.345 -3.427 -1.156
6 C26 C C6 N Y N 0 -3.181 -1.776 0.159
7 C28 C C7 N Y N 0 -1.836 -2.143 -0.278
8 C02 C C8 N N N 0 4.116 -1.504 2.467
9 N03 N N1 N N N 0 5.001 -0.757 1.57
10 S04 S S1 N N N 0 4.604 -0.583 -0.028
11 O05 O O1 N N N 0 5.629 0.208 -0.613
12 O06 O O2 N N N 0 4.259 -1.879 -0.499
13 C07 C C9 N Y N 0 3.131 0.38 -0.099
14 C08 C C10 N Y N 0 3.212 1.758 -0.181
15 C09 C C11 N Y N 0 2.059 2.52 -0.237
16 N11 N N2 N N N 0 -0.35 2.672 -0.267
17 N18 N N3 N N N 0 -0.514 -0.118 -0.112
18 C12 C C12 N N N 0 -0.464 3.544 0.911
19 O14 O O3 N N N 0 -1.826 5.058 -0.387
20 C16 C C13 N N N 0 -0.401 3.462 -1.506
21 C19 C C14 N Y N 0 -0.617 -1.462 -0.422
22 N20 N N4 N Y N 0 0.437 -2.142 -0.866
23 N22 N N5 N Y N 0 -0.775 -4.106 -1.031
24 C23 C C15 N Y N 0 -1.886 -3.512 -0.599
25 N24 N N6 N Y N 0 -3.167 -3.934 -0.37
26 C25 C C16 N Y N 0 -3.931 -2.888 0.082
27 BR2 BR BR1 N N N 0 -3.753 -0.068 0.734
28 C29 C C17 N Y N 0 1.897 -0.244 -0.077
29 H1 H H1 N N N 0 -2.618 3.624 0.874
30 H2 H H2 N N N 0 -1.845 5.011 1.68
31 H3 H H3 N N N 0 -2.553 3.541 -1.589
32 H4 H H4 N N N 0 -1.736 4.871 -2.444
33 H5 H H5 N N N 0 1.225 -3.941 -1.513
34 H6 H H6 N N N 0 4.54 -1.51 3.472
35 H7 H H7 N N N 0 3.136 -1.028 2.49
36 H8 H H8 N N N 0 4.016 -2.528 2.109
37 H9 H H9 N N N 0 5.819 -0.363 1.912
38 H10 H H10 N N N 0 4.178 2.24 -0.201
39 H11 H H11 N N N 0 2.126 3.596 -0.301
40 H12 H H12 N N N 0 0.371 4.244 0.929
41 H13 H H13 N N N 0 -0.45 2.937 1.816
42 H14 H H14 N N N 0 -0.34 2.795 -2.366
43 H15 H H15 N N N 0 0.436 4.161 -1.527
44 H16 H H16 N N N 0 -1.309 0.388 0.12
45 H17 H H17 N N N 0 -3.488 -4.838 -0.508
46 H18 H H18 N N N 0 -4.979 -2.95 0.338
47 H19 H H19 N N N 0 1.838 -1.321 -0.017