Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : QWP

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 152


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 CAA C C1 N N N 0 5.971 -7.614 -0.756
2 CAB C C2 S N N 0 4.782 -8.423 -1.283
3 CAC C C3 N N N 0 5.263 -9.8 -1.745
4 OAD O O1 N N N 0 4.184 -7.732 -2.382
5 CAE C C4 R N N 0 3.754 -8.59 -0.16
6 OAF O O2 N N N 0 2.607 -9.28 -0.66
7 CAG C C5 R N N 0 3.337 -7.207 0.35
8 CAH C C6 N N N 0 2.355 -7.366 1.512
9 OAI O O3 N N N 0 4.494 -6.497 0.796
10 CAJ C C7 S N N 0 5.469 -6.27 -0.224
11 OAK O O4 N N N 0 6.565 -5.533 0.321
12 CAL C C8 R N N 0 6.224 -4.212 0.746
13 CAM C C9 N N N 0 6.416 -3.234 -0.417
14 CAN C C10 S N N 0 7.135 -3.795 1.905
15 OAO O O5 N N N 0 8.501 -3.888 1.496
16 CAP C C11 R N N 0 6.815 -2.352 2.301
17 CAQ C C12 N N N 0 7.761 -1.908 3.419
18 OAR O O6 N N N 0 6.984 -1.499 1.167
19 CAS C C13 S N N 0 6.124 -1.812 0.069
20 OAT O O7 N N N 0 6.356 -0.887 -0.996
21 CAU C C14 R N N 0 6.005 0.462 -0.681
22 CAV C C15 N N N 0 4.543 0.713 -1.06
23 CAW C C16 R N N 0 6.899 1.422 -1.472
24 OAX O O8 N N N 0 8.26 1.245 -1.074
25 CAY C C17 R N N 0 6.464 2.862 -1.189
26 CAZ C C18 N N N 0 7.313 3.824 -2.022
27 OBA O O9 N N N 0 5.087 3.019 -1.535
28 CBB C C19 S N N 0 4.199 2.181 -0.793
29 OBC O O10 N N N 0 2.852 2.437 -1.197
30 CBD C C20 S N N 0 2.393 3.753 -0.887
31 CBE C C21 S N N 0 1.351 4.199 -1.922
32 CBF C C22 N N N 0 0.228 3.169 -1.985
33 CBG C C23 S N N 0 0.776 5.557 -1.515
34 OBH O O11 N N N 0 -0.263 5.926 -2.424
35 CBI C C24 N N N 0 -1.542 6.089 -1.808
36 CBJ C C25 N N N 0 1.868 6.596 -1.551
37 OBK O O12 N N N 0 2.018 7.28 -2.535
38 CBL C C26 S N N 0 2.772 6.781 -0.36
39 OBM O O13 N N N 0 3.953 7.479 -0.762
40 CBN C C27 R N N 0 2.042 7.591 0.713
41 CBO C C28 N N N 0 3.0 7.885 1.869
42 OBP O O14 N N N 0 1.582 8.821 0.151
43 CBQ C C29 N N N 0 1.716 3.757 0.467
44 OBR O O15 N N N 0 2.277 4.2 1.448
45 CBS C C30 N Y N 0 0.357 3.207 0.554
46 CBT C C31 N Y N 0 -0.205 2.969 1.812
47 OBU O O16 N N N 0 0.499 3.238 2.937
48 CBV C C32 N Y N 0 -0.367 2.927 -0.623
49 CBW C C33 N Y N 0 -1.629 2.426 -0.544
50 CBX C C34 N Y N 0 -2.226 2.175 0.707
51 CBY C C35 N Y N 0 -3.526 1.658 0.791
52 CBZ C C36 N Y N 0 -1.508 2.447 1.898
53 CCA C C37 N Y N 0 -2.107 2.193 3.149
54 OCB O O17 N N N 0 -1.428 2.448 4.296
55 CCC C C38 N Y N 0 -3.386 1.685 3.2
56 CCD C C39 N N N 0 -4.028 1.414 4.536
57 CCE C C40 N Y N 0 -4.092 1.418 2.026
58 OCF O O18 N N N 0 -5.352 0.918 2.101
59 CCG C C41 S N N 0 -6.024 0.666 0.865
60 CCH C C42 N N N 0 -7.371 -0.007 1.144
61 OCI O O19 N N N 0 -6.244 1.902 0.182
62 CCJ C C43 R N N 0 -6.89 1.762 -1.085
63 CCN C C46 R N N 0 -8.111 -0.218 -0.18
64 CCK C C44 N N N 0 -7.046 3.139 -1.733
65 CCL C C45 R N N 0 -8.272 1.133 -0.884
66 OCM O O20 N N N 0 -8.897 0.939 -2.154
67 OCO O O21 N N N 0 -9.4 -0.779 0.077
68 CCP C C47 S N N 0 -9.42 -2.207 0.091
69 CCQ C C48 N N N 0 -10.814 -2.694 0.495
70 OCR O O22 N N N 0 -9.104 -2.701 -1.212
71 CCS C C49 R N N 0 -9.071 -4.127 -1.303
72 CCT C C50 N N N 0 -8.696 -4.538 -2.729
73 CCU C C51 S N N 0 -10.451 -4.691 -0.955
74 OCV O O23 N N N 0 -10.406 -6.119 -0.989
75 CCW C C52 R N N 0 -10.845 -4.225 0.45
76 OCX O O24 N N N 0 -12.163 -4.686 0.754
77 H1 H H1 N N N 0 6.458 -8.165 0.049
78 H2 H H2 N N N 0 6.683 -7.444 -1.564
79 H3 H H3 N N N 0 5.716 -10.327 -0.905
80 H4 H H4 N N N 0 4.416 -10.374 -2.12
81 H5 H H5 N N N 0 6.0 -9.679 -2.539
82 H6 H H6 N N N 0 4.782 -7.587 -3.127
83 H7 H H7 N N N 0 4.196 -9.161 0.657
84 H8 H H8 N N N 0 1.914 -9.42 -0.001
85 H9 H H9 N N N 0 2.858 -6.652 -0.457
86 H10 H H10 N N N 0 2.834 -7.921 2.319
87 H11 H H11 N N N 0 2.058 -6.382 1.874
88 H12 H H12 N N N 0 1.473 -7.909 1.171
89 H13 H H13 N N N 0 5.018 -5.702 -1.038
90 H14 H H14 N N N 0 5.184 -4.191 1.072
91 H15 H H15 N N N 0 7.444 -3.292 -0.776
92 H16 H H16 N N N 0 5.732 -3.491 -1.226
93 H17 H H17 N N N 0 6.964 -4.453 2.757
94 H18 H H18 N N N 0 9.135 -3.638 2.182
95 H19 H H19 N N N 0 5.785 -2.29 2.652
96 H20 H H20 N N N 0 7.535 -0.879 3.7
97 H21 H H21 N N N 0 7.633 -2.558 4.284
98 H22 H H22 N N N 0 8.792 -1.969 3.068
99 H23 H H23 N N N 0 5.085 -1.743 0.39
100 H24 H H24 N N N 0 6.14 0.634 0.387
101 H25 H H25 N N N 0 4.398 0.492 -2.118
102 H26 H H26 N N N 0 3.896 0.072 -0.462
103 H27 H H27 N N N 0 6.801 1.215 -2.538
104 H28 H H28 N N N 0 8.883 1.822 -1.536
105 H29 H H29 N N N 0 6.6 3.081 -0.13
106 H30 H H30 N N N 0 7.176 3.605 -3.081
107 H31 H H31 N N N 0 7.003 4.85 -1.82
108 H32 H H32 N N N 0 8.364 3.703 -1.759
109 H33 H H33 N N N 0 4.306 2.391 0.272
110 H34 H H34 N N N 0 3.233 4.448 -0.884
111 H35 H H35 N N N 0 1.824 4.282 -2.901
112 H36 H H36 N N N 0 -0.552 3.531 -2.656
113 H37 H H37 N N N 0 0.624 2.231 -2.373
114 H38 H H38 N N N 0 0.37 5.493 -0.506
115 H39 H H39 N N N 0 -1.511 6.938 -1.125
116 H40 H H40 N N N 0 -2.295 6.268 -2.576
117 H41 H H41 N N N 0 -1.797 5.186 -1.254
118 H42 H H42 N N N 0 3.046 5.806 0.043
119 H43 H H43 N N N 0 3.785 8.356 -1.132
120 H44 H H44 N N N 0 1.191 7.019 1.083
121 H45 H H45 N N N 0 3.851 8.457 1.499
122 H46 H H46 N N N 0 2.48 8.462 2.634
123 H47 H H47 N N N 0 3.352 6.947 2.298
124 H48 H H48 N N N 0 2.287 9.382 -0.199
125 H49 H H49 N N N 0 0.375 4.137 3.272
126 H50 H H50 N N N 0 -2.179 2.218 -1.45
127 H51 H H51 N N N 0 -4.084 1.448 -0.109
128 H52 H H52 N N N 0 -1.558 3.343 4.639
129 H53 H H53 N N N 0 -4.562 2.303 4.87
130 H54 H H54 N N N 0 -4.729 0.584 4.44
131 H55 H H55 N N N 0 -3.259 1.157 5.264
132 H56 H H56 N N N 0 -5.412 0.012 0.244
133 H57 H H57 N N N 0 -7.204 -0.97 1.625
134 H58 H H58 N N N 0 -7.968 0.63 1.798
135 H59 H H59 N N N 0 -6.29 1.122 -1.731
136 H60 H H60 N N N 0 -6.063 3.587 -1.875
137 H61 H H61 N N N 0 -7.539 3.032 -2.699
138 H62 H H62 N N N 0 -7.647 3.779 -1.087
139 H63 H H63 N N N 0 -8.887 1.793 -0.272
140 H64 H H64 N N N 0 -9.026 1.754 -2.658
141 H65 H H65 N N N 0 -7.538 -0.894 -0.815
142 H66 H H66 N N N 0 -8.685 -2.574 0.807
143 H67 H H67 N N N 0 -11.04 -2.355 1.507
144 H68 H H68 N N N 0 -11.555 -2.295 -0.197
145 H69 H H69 N N N 0 -8.331 -4.519 -0.605
146 H70 H H70 N N N 0 -7.714 -4.136 -2.977
147 H71 H H71 N N N 0 -8.671 -5.626 -2.798
148 H72 H H72 N N N 0 -9.436 -4.147 -3.426
149 H73 H H73 N N N 0 -11.184 -4.333 -1.678
150 H74 H H74 N N N 0 -10.157 -6.484 -1.85
151 H75 H H75 N N N 0 -10.14 -4.626 1.178
152 H76 H H76 N N N 0 -12.48 -4.421 1.629