Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 748

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 78


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C4 C C1 N Y N 0 -7.313 1.25 -0.197
2 C5 C C2 N Y N 0 -6.334 1.809 -1.022
3 C6 C C3 N Y N 0 -5.112 1.168 -1.121
4 N1 N N1 N Y N 0 -4.908 0.054 -0.438
5 N3 N N2 N Y N 0 -7.038 0.126 0.461
6 C2 C C4 N Y N 0 -5.855 -0.455 0.337
7 CAA C C5 N N N 0 -5.608 -4.464 1.182
8 CAB C C6 N N N 0 7.753 4.837 1.059
9 CAC C C7 N N N 0 5.574 4.138 1.849
10 CAF C C8 N Y N 0 9.161 0.075 1.712
11 CAG C C9 N Y N 0 -10.835 1.993 0.879
12 CAH C C10 N Y N 0 9.492 -1.263 1.824
13 CAI C C11 N Y N 0 -11.045 3.158 0.164
14 CAK C C12 N Y N 0 8.24 0.468 0.757
15 CAL C C13 N Y N 0 -9.616 1.346 0.777
16 CAM C C14 N Y N 0 2.571 0.801 -0.686
17 CAN C C15 N Y N 0 3.394 -0.978 -2.072
18 CAO C C16 N Y N 0 -3.147 -4.348 0.749
19 CAQ C C17 N Y N 0 -1.987 -3.636 0.511
20 CAR C C18 N Y N 0 1.451 0.055 -0.381
21 CAS C C19 N Y N 0 2.276 -1.732 -1.779
22 CAT C C20 N Y N 0 8.071 -1.843 0.105
23 CAU C C21 N Y N 0 -8.927 3.079 -0.74
24 CAV C C22 N Y N 0 -3.223 -1.578 0.627
25 CAW C C23 N N N 0 6.638 2.952 0.026
26 CAX C C24 N N N 0 5.906 1.644 0.332
27 CAY C C25 N N N 0 4.756 1.111 -1.866
28 CBF C C26 N N N 0 0.1 -2.026 -0.604
29 CBG C C27 N N N 0 6.699 -0.151 -1.113
30 CBH C C28 N Y N 0 3.539 0.288 -1.532
31 CBI C C29 N Y N 0 -4.345 -3.684 0.922
32 CBJ C C30 N Y N 0 -2.022 -2.249 0.449
33 CBK C C31 N Y N 0 1.296 -1.22 -0.927
34 CBL C C32 N Y N 0 7.68 -0.515 -0.068
35 CBM C C33 N Y N 0 -8.638 1.902 -0.052
36 CBO C C34 N Y N 0 -4.388 -2.296 0.855
37 NAZ N N3 N Y N 0 8.944 -2.168 1.036
38 NBA N N4 N Y N 0 -10.102 3.659 -0.611
39 NBD N N5 N N N 0 -0.845 -1.529 0.219
40 NBE N N6 N N N 0 -5.601 -1.624 1.035
41 NBQ N N7 N N N 0 6.852 3.697 1.274
42 NBR N N8 N N N 0 5.813 0.839 -0.889
43 OAD O O1 N N N 0 -0.033 -3.136 -1.08
44 OAE O O2 N N N 0 6.692 -0.744 -2.174
45 H1 H H1 N N N 0 -6.527 2.72 -1.569
46 H2 H H2 N N N 0 -4.333 1.574 -1.75
47 H3 H H3 N N N 0 -5.737 -4.598 2.256
48 H4 H H4 N N N 0 -6.462 -3.919 0.778
49 H5 H H5 N N N 0 -5.538 -5.439 0.699
50 H6 H H6 N N N 0 7.894 5.371 1.998
51 H7 H H7 N N N 0 8.716 4.476 0.698
52 H8 H H8 N N N 0 7.318 5.51 0.32
53 H9 H H9 N N N 0 5.092 4.841 1.169
54 H10 H H10 N N N 0 4.925 3.275 1.998
55 H11 H H11 N N N 0 5.755 4.626 2.807
56 H12 H H12 N N N 0 9.613 0.806 2.366
57 H13 H H13 N N N 0 -11.613 1.595 1.514
58 H14 H H14 N N N 0 10.211 -1.572 2.568
59 H15 H H15 N N N 0 -11.995 3.665 0.241
60 H16 H H16 N N N 0 7.959 1.505 0.651
61 H17 H H17 N N N 0 -9.425 0.435 1.325
62 H18 H H18 N N N 0 2.69 1.79 -0.269
63 H19 H H19 N N N 0 4.153 -1.372 -2.731
64 H20 H H20 N N N 0 -3.117 -5.427 0.798
65 H21 H H21 N N N 0 -1.052 -4.159 0.374
66 H22 H H22 N N N 0 0.697 0.456 0.279
67 H23 H H23 N N N 0 2.164 -2.72 -2.201
68 H24 H H24 N N N 0 7.648 -2.613 -0.524
69 H25 H H25 N N N 0 -8.18 3.52 -1.384
70 H26 H H26 N N N 0 -3.251 -0.499 0.588
71 H27 H H27 N N N 0 7.601 2.731 -0.434
72 H28 H H28 N N N 0 6.038 3.553 -0.658
73 H29 H H29 N N N 0 6.457 1.089 1.092
74 H30 H H30 N N N 0 4.904 1.865 0.699
75 H31 H H31 N N N 0 5.108 0.85 -2.864
76 H32 H H32 N N N 0 4.497 2.17 -1.837
77 H33 H H33 N N N 0 -0.709 -0.672 0.652
78 H34 H H34 N N N 0 -6.264 -1.976 1.649