Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : HWP

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 127


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N N N 0 -6.726 2.205 0.42
2 C13 C C2 N N N 0 -3.698 -0.05 -0.334
3 C15 C C3 N N N 0 -1.593 -1.394 -0.276
4 C20 C C4 N N N 0 1.254 -4.274 1.729
5 C26 C C5 N N N 0 -0.285 -9.106 0.263
6 P22 P P1 N N N 0 0.558 -6.831 1.382
7 C1 C C6 N N N 0 -16.328 8.018 -0.68
8 C2 C C7 N N N 0 -15.146 7.583 0.19
9 C3 C C8 N N N 0 -14.223 6.673 -0.622
10 C4 C C9 N N N 0 -13.041 6.239 0.248
11 C5 C C10 N N N 0 -12.118 5.329 -0.564
12 C6 C C11 N N N 0 -10.936 4.894 0.305
13 C11 C C15 N N N 0 -5.803 1.295 -0.392
14 C7 C C12 N N N 0 -10.013 3.984 -0.507
15 C8 C C13 N N N 0 -8.831 3.55 0.363
16 C9 C C14 N N N 0 -7.908 2.639 -0.449
17 C12 C C16 N N N 0 -4.621 0.86 0.478
18 C14 C C17 N N N 0 -2.516 -0.484 0.536
19 C16 C C18 N N N 0 -0.429 -1.822 0.58
20 O17 O O1 N N N 0 -0.346 -1.437 1.727
21 N18 N N1 N N N 0 0.52 -2.633 0.072
22 C19 C C19 S N N 0 1.651 -3.049 0.904
23 O21 O O2 N N N 0 1.001 -5.376 0.855
24 O23 O O3 N N N -1 1.705 -7.448 2.213
25 O24 O O4 N N N 0 -0.703 -6.697 2.265
26 O25 O O5 N N N 0 0.235 -7.782 0.124
27 C27 C C20 N N N 0 -0.475 -9.727 -1.122
28 N28 N N2 N N N 1 0.837 -9.94 -1.748
29 C29 C C21 N N N 0 0.662 -10.65 -3.022
30 C30 C C22 N N N 0 1.478 -8.642 -1.995
31 C31 C C23 N N N 0 1.682 -10.741 -0.853
32 C32 C C24 R N N 0 2.841 -3.4 0.009
33 C33 C C25 N N N 0 3.294 -2.169 -0.732
34 C34 C C26 N N N 0 4.541 -1.776 -0.65
35 C35 C C27 N N N 0 4.994 -0.544 -1.39
36 C36 C C28 N N N 0 5.642 0.432 -0.407
37 C37 C C29 N N N 0 6.102 1.683 -1.16
38 C38 C C30 N N N 0 6.75 2.66 -0.177
39 C39 C C31 N N N 0 7.21 3.91 -0.929
40 C40 C C32 N N N 0 7.858 4.887 0.054
41 C41 C C33 N N N 0 8.318 6.138 -0.698
42 C42 C C34 N N N 0 8.967 7.115 0.285
43 C43 C C35 N N N 0 9.426 8.365 -0.467
44 C44 C C36 N N N 0 10.075 9.342 0.516
45 C45 C C37 N N N 0 10.534 10.593 -0.237
46 C46 C C38 N N N 0 11.183 11.569 0.746
47 C47 C C39 N N N 0 11.642 12.82 -0.006
48 O48 O O6 N N N 0 3.914 -3.893 0.815
49 H1 H H1 N N N 0 -6.173 3.085 0.748
50 H2 H H2 N N N 0 -7.096 1.664 1.291
51 H3 H H3 N N N 0 -4.251 -0.93 -0.661
52 H4 H H4 N N N 0 -3.328 0.491 -1.205
53 H5 H H5 N N N 0 -2.146 -2.275 -0.604
54 H6 H H6 N N N 0 -1.223 -0.853 -1.147
55 H7 H H7 N N N 0 2.064 -4.531 2.412
56 H11 H H11 N N N 0 -16.986 8.666 -0.101
57 H8 H H8 N N N 0 0.354 -4.051 2.302
58 H9 H H9 N N N 0 0.414 -9.712 0.84
59 H10 H H10 N N N 0 -1.244 -9.068 0.78
60 H12 H H12 N N N 0 -15.958 8.559 -1.551
61 H13 H H13 N N N 0 -16.881 7.137 -1.007
62 H14 H H14 N N N 0 -14.593 8.464 0.517
63 H15 H H15 N N N 0 -15.516 7.042 1.061
64 H16 H H16 N N N 0 -14.776 5.793 -0.949
65 H17 H H17 N N N 0 -13.853 7.214 -1.493
66 H18 H H18 N N N 0 -12.488 7.119 0.575
67 H22 H H22 N N N 0 -10.383 5.774 0.632
68 H19 H H19 N N N 0 -13.411 5.698 1.118
69 H20 H H20 N N N 0 -12.671 4.448 -0.892
70 H21 H H21 N N N 0 -11.748 5.87 -1.436
71 H23 H H23 N N N 0 -11.306 4.353 1.176
72 H24 H H24 N N N 0 -10.566 3.104 -0.834
73 H25 H H25 N N N 0 -9.643 4.525 -1.378
74 H26 H H26 N N N 0 -8.278 4.43 0.69
75 H27 H H27 N N N 0 -9.201 3.008 1.234
76 H28 H H28 N N N 0 -7.538 3.181 -1.32
77 H29 H H29 N N N 0 -8.461 1.759 -0.776
78 H30 H H30 N N N 0 -6.356 0.414 -0.719
79 H31 H H31 N N N 0 -5.433 1.836 -1.263
80 H32 H H32 N N N 0 -4.991 0.319 1.349
81 H33 H H33 N N N 0 -4.068 1.741 0.805
82 H34 H H34 N N N 0 -1.963 0.396 0.863
83 H35 H H35 N N N 0 -2.886 -1.025 1.407
84 H36 H H36 N N N 0 0.454 -2.941 -0.846
85 H37 H H37 N N N 0 1.929 -2.234 1.574
86 H39 H H39 N N N 0 -0.99 -10.683 -1.024
87 H40 H H40 N N N 0 -1.069 -9.057 -1.742
88 H41 H H41 N N N 0 0.186 -11.614 -2.839
89 H42 H H42 N N N 0 0.034 -10.056 -3.686
90 H43 H H43 N N N 0 1.635 -10.808 -3.486
91 H44 H H44 N N N 0 2.368 -8.786 -2.606
92 H45 H H45 N N N 0 0.781 -7.986 -2.517
93 H46 H H46 N N N 0 1.76 -8.189 -1.044
94 H47 H H47 N N N 0 1.207 -11.705 -0.67
95 H48 H H48 N N N 0 2.656 -10.899 -1.317
96 H49 H H49 N N N 0 1.812 -10.215 0.093
97 H50 H H50 N N N 0 2.543 -4.166 -0.707
98 H51 H H51 N N N 0 2.59 -1.609 -1.33
99 H52 H H52 N N N 0 5.245 -2.336 -0.051
100 H53 H H53 N N N 0 5.719 -0.826 -2.155
101 H54 H H54 N N N 0 4.135 -0.068 -1.862
102 H55 H H55 N N N 0 4.918 0.714 0.356
103 H56 H H56 N N N 0 6.502 -0.044 0.064
104 H57 H H57 N N N 0 6.826 1.402 -1.924
105 H58 H H58 N N N 0 5.243 2.159 -1.632
106 H59 H H59 N N N 0 6.026 2.941 0.587
107 H60 H H60 N N N 0 7.61 2.183 0.295
108 H61 H H61 N N N 0 7.935 3.629 -1.693
109 H62 H H62 N N N 0 6.351 4.387 -1.401
110 H63 H H63 N N N 0 7.134 5.168 0.818
111 H64 H H64 N N N 0 8.718 4.411 0.526
112 H65 H H65 N N N 0 9.043 5.857 -1.462
113 H66 H H66 N N N 0 7.459 6.614 -1.17
114 H67 H H67 N N N 0 8.242 7.396 1.049
115 H68 H H68 N N N 0 9.826 6.638 0.757
116 H69 H H69 N N N 0 10.151 8.084 -1.232
117 H70 H H70 N N N 0 8.567 8.842 -0.939
118 H71 H H71 N N N 0 9.35 9.623 1.28
119 H72 H H72 N N N 0 10.934 8.866 0.988
120 H73 H H73 N N N 0 11.259 10.311 -1.001
121 H74 H H74 N N N 0 9.675 11.069 -0.709
122 H75 H H75 N N N 0 10.458 11.851 1.51
123 H76 H H76 N N N 0 12.042 11.093 1.218
124 H77 H H77 N N N 0 12.104 13.516 0.694
125 H78 H H78 N N N 0 12.367 12.539 -0.77
126 H79 H H79 N N N 0 10.783 13.296 -0.478
127 H80 H H80 N N N 0 4.177 -3.295 1.527