Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 3AJ

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 86


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N32 N N32 N N N 0 6.204 4.12 1.556
2 C29 C C29 N N N 0 6.774 3.486 0.805
3 C28 C C28 N N N 0 7.514 2.664 -0.167
4 C31 C C31 N N N 0 8.497 3.381 -1.095
5 C30 C C30 N N N 0 9.021 2.505 0.044
6 C27 C C27 N N N 0 6.75 1.467 -0.736
7 O25 O O25 N N N 0 5.887 0.931 0.269
8 C19 C C19 S N N 0 5.123 -0.197 -0.162
9 C18 C C18 R N N 0 4.858 -1.117 1.031
10 O24 O O24 N N N 0 6.096 -1.441 1.665
11 C17 C C17 N N N 0 4.177 -2.404 0.552
12 C20 C C20 R N N 0 3.793 0.284 -0.752
13 O23 O O23 N N N 0 3.079 1.042 0.225
14 C21 C C21 N N N 0 2.98 -0.932 -1.151
15 C22 C C22 N N N 0 2.372 -1.008 -2.334
16 C16 C C16 N N N 0 2.895 -2.028 -0.164
17 C15 C C15 N N N 0 1.733 -2.664 0.088
18 C14 C C14 N N N 0 0.514 -2.273 -0.624
19 C4 C C4 N N N 0 -0.635 -2.901 -0.375
20 C3 C C3 N N N 0 -0.744 -4.027 0.642
21 C2 C C2 N N N 0 -1.904 -3.776 1.604
22 C5 C C5 S N N 0 -1.913 -2.544 -1.073
23 C7 C C7 N N N 0 -1.905 -1.263 -1.911
24 C8 C C8 N N N 0 -3.408 -0.869 -1.951
25 C9 C C9 R N N 0 -4.061 -1.514 -0.701
26 C6 C C6 R N N 0 -2.911 -2.161 0.056
27 C10 C C10 N N N 0 -2.261 -1.121 0.971
28 C1 C C1 N N N 0 -3.195 -3.406 0.855
29 C11 C C11 R N N 0 -4.732 -0.443 0.161
30 C26 C C26 N N N 0 -5.338 -1.096 1.406
31 C12 C C12 N N N 0 -5.838 0.242 -0.645
32 C13 C C13 N N N 0 -6.424 1.395 0.172
33 C33 C C33 N N N 0 -7.53 2.08 -0.634
34 C34 C C34 N N N 0 -8.117 3.233 0.182
35 O37 O O37 N N N 0 -8.662 2.724 1.402
36 C36 C C36 N N N 0 -7.015 4.246 0.5
37 C35 C C35 N N N 0 -9.222 3.918 -0.624
38 H1 H H1 N N N 0 8.599 3.0 -2.111
39 H2 H H2 N N N 0 8.595 4.461 -0.986
40 H3 H H3 N N N 0 9.465 3.009 0.903
41 H4 H H4 N N N 0 9.468 1.547 -0.222
42 H5 H H5 N N N 0 6.155 1.789 -1.591
43 H6 H H6 N N N 0 7.458 0.701 -1.053
44 H7 H H7 N N N 0 5.681 -0.743 -0.923
45 H8 H H8 N N N 0 4.208 -0.608 1.743
46 H9 H H9 N N N 0 6.005 -2.023 2.431
47 H10 H H10 N N N 0 4.838 -2.935 -0.132
48 H11 H H11 N N N 0 3.948 -3.037 1.409
49 H12 H H12 N N N 0 3.984 0.902 -1.63
50 H13 H H13 N N N 0 2.226 1.377 -0.083
51 H14 H H14 N N N 0 2.452 -0.191 -3.036
52 H15 H H15 N N N 0 1.799 -1.887 -2.591
53 H16 H H16 N N N 0 1.7 -3.462 0.816
54 H17 H H17 N N N 0 0.547 -1.475 -1.352
55 H18 H H18 N N N 0 -0.909 -4.969 0.119
56 H19 H H19 N N N 0 0.185 -4.09 1.21
57 H20 H H20 N N N 0 -2.08 -4.678 2.191
58 H21 H H21 N N N 0 -1.638 -2.962 2.277
59 H22 H H22 N N N 0 -2.28 -3.386 -1.66
60 H23 H H23 N N N 0 -1.314 -0.487 -1.424
61 H24 H H24 N N N 0 -1.531 -1.462 -2.916
62 H25 H H25 N N N 0 -3.512 0.215 -1.91
63 H26 H H26 N N N 0 -3.873 -1.255 -2.858
64 H27 H H27 N N N 0 -4.789 -2.269 -1.001
65 H28 H H28 N N N 0 -2.12 -0.191 0.421
66 H29 H H29 N N N 0 -2.905 -0.941 1.831
67 H30 H H30 N N N 0 -1.294 -1.492 1.312
68 H31 H H31 N N N 0 -3.485 -4.22 0.191
69 H32 H H32 N N N 0 -3.994 -3.21 1.571
70 H33 H H33 N N N 0 -3.991 0.297 0.463
71 H34 H H34 N N N 0 -5.816 -0.332 2.02
72 H35 H H35 N N N 0 -6.079 -1.836 1.104
73 H36 H H36 N N N 0 -4.55 -1.583 1.98
74 H37 H H37 N N N 0 -5.422 0.63 -1.575
75 H38 H H38 N N N 0 -6.622 -0.48 -0.871
76 H39 H H39 N N N 0 -6.84 1.007 1.102
77 H40 H H40 N N N 0 -5.639 2.116 0.398
78 H41 H H41 N N N 0 -7.114 2.468 -1.564
79 H42 H H42 N N N 0 -8.315 1.358 -0.86
80 H43 H H43 N N N 0 -9.367 2.075 1.276
81 H44 H H44 N N N 0 -6.599 4.634 -0.43
82 H45 H H45 N N N 0 -7.433 5.067 1.082
83 H46 H H46 N N N 0 -6.227 3.758 1.074
84 H47 H H47 N N N 0 -8.807 4.306 -1.554
85 H48 H H48 N N N 0 -10.007 3.196 -0.85
86 H49 H H49 N N N 0 -9.641 4.739 -0.042