Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : CI9

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 98


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 OAA O OAA N N N 0 14.612 -2.588 1.98
2 CBN C CBN N N N 0 13.431 -3.184 1.75
3 OAG O OAG N N N 0 13.11 -4.156 2.391
4 CAZ C CAZ N N N 0 12.506 -2.639 0.692
5 CBB C CBB N N N 0 11.239 -3.495 0.634
6 CBW C CBW S N N 0 10.3 -2.942 -0.44
7 CBP C CBP N N N 0 9.109 -3.854 -0.584
8 OAI O OAI N N N 0 9.285 -5.137 -0.936
9 OAC O OAC N N N 0 7.995 -3.431 -0.381
10 NBI N NBI N N N 0 9.846 -1.605 -0.051
11 CBQ C CBQ N N N 0 9.45 -0.726 -0.993
12 OAD O OAD N N N 0 9.469 -1.044 -2.166
13 N N N N N N 0 9.032 0.504 -0.635
14 CA C CA S N N 0 8.602 1.459 -1.659
15 C C C N N N 0 9.804 2.184 -2.207
16 OXT O OXT N N Y 0 10.907 1.929 -1.786
17 O O O N N N 0 9.649 3.112 -3.164
18 CB C CB N N N 0 7.635 2.47 -1.039
19 CAP C CAP N N N 0 6.36 1.75 -0.595
20 CAQ C CAQ N N N 0 5.393 2.761 0.025
21 CBC C CBC N N N 0 4.118 2.042 0.469
22 NBX N NBX N Y N 0 3.193 3.01 1.062
23 CAO C CAO N Y N 0 1.912 3.22 0.679
24 NBF N NBF N Y N 0 3.456 3.803 2.041
25 NBE N NBE N Y N 0 2.427 4.524 2.318
26 CBR C CBR N Y N 0 1.431 4.193 1.488
27 CBD C CBD N N N 0 0.045 4.785 1.461
28 OBM O OBM N N N 0 -0.72 4.159 0.43
29 CAY C CAY N N N 0 -2.057 4.65 0.319
30 CAX C CAX N N N 0 -2.78 3.912 -0.81
31 OBL O OBL N N N 0 -2.912 2.531 -0.469
32 CAW C CAW N N N 0 -3.577 1.748 -1.462
33 CAV C CAV N N N 0 -3.661 0.294 -0.993
34 OBK O OBK N N N 0 -4.49 0.215 0.168
35 CAS C CAS N N N 0 -7.783 -0.604 2.625
36 CAU C CAU N N N 0 -4.636 -1.107 0.689
37 CAT C CAT N N N 0 -5.539 -1.071 1.924
38 OBJ O OBJ N N N 0 -6.856 -0.669 1.54
39 CAR C CAR N N N 0 -9.152 -0.165 2.1
40 NBG N NBG N N N 0 -9.681 -1.192 1.199
41 CBT C CBT N Y N 0 -10.933 -1.014 0.59
42 CAM C CAM N Y N 0 -11.668 0.134 0.84
43 CAL C CAL N Y N 0 -12.902 0.311 0.24
44 CBU C CBU N Y N 0 -11.434 -1.988 -0.272
45 CBS C CBS N Y N 0 -13.407 -0.661 -0.614
46 NBY N NBY N N N 0 -14.656 -0.479 -1.219
47 OAJ O OAJ N N N 0 -15.403 0.696 -0.961
48 OAE O OAE N N N 0 -15.171 -1.469 -2.09
49 CAN C CAN N Y N 0 -12.674 -1.812 -0.868
50 NBZ N NBZ N N N 0 -10.691 -3.146 -0.53
51 HAZ1 H HAZ1 N N N 0 12.239 -1.611 0.938
52 OAK O OAK N N N 0 -11.015 -4.202 0.428
53 OAF O OAF N N N 0 -10.895 -3.605 -1.905
54 HAA H HAA N N N 0 15.171 -2.973 2.668
55 HAZ2 H HAZ2 N N N 0 13.006 -2.663 -0.275
56 HBB1 H HBB1 N N N 0 11.506 -4.523 0.389
57 HAI H HAI N N N 0 8.491 -5.684 -1.016
58 HBB2 H HBB2 N N N 0 10.739 -3.47 1.602
59 HBW H HBW N N N 0 10.829 -2.884 -1.391
60 HBI H HBI N N N 0 9.831 -1.351 0.886
61 H H H N N N 0 9.017 0.757 0.302
62 HA H HA N N N 0 8.1 0.924 -2.466
63 HB1C H HB1C N N N 0 8.106 2.941 -0.177
64 HB2C H HB2C N N N 0 7.384 3.232 -1.777
65 HXT H HXT N N Y 0 10.449 3.55 -3.484
66 HAP1 H HAP1 N N N 0 5.889 1.279 -1.458
67 HAP2 H HAP2 N N N 0 6.611 0.988 0.143
68 HAQ1 H HAQ1 N N N 0 5.864 3.233 0.887
69 HAQ2 H HAQ2 N N N 0 5.142 3.523 -0.713
70 HBC1 H HBC1 N N N 0 3.647 1.571 -0.394
71 HBC2 H HBC2 N N N 0 4.369 1.28 1.207
72 HAO H HAO N N N 0 1.38 2.714 -0.113
73 HBD1 H HBD1 N N N 0 -0.439 4.621 2.424
74 HBD2 H HBD2 N N N 0 0.111 5.855 1.266
75 HAY1 H HAY1 N N N 0 -2.585 4.483 1.258
76 HAY2 H HAY2 N N N 0 -2.035 5.718 0.1
77 HAX1 H HAX1 N N N 0 -3.769 4.347 -0.954
78 HAX2 H HAX2 N N N 0 -2.205 4.006 -1.731
79 HAW1 H HAW1 N N N 0 -4.582 2.138 -1.619
80 HAW2 H HAW2 N N N 0 -3.018 1.796 -2.397
81 HAV1 H HAV1 N N N 0 -4.087 -0.319 -1.787
82 HAV2 H HAV2 N N N 0 -2.662 -0.068 -0.751
83 HAT2 H HAT2 N N N 0 -5.139 -0.361 2.647
84 HAU1 H HAU1 N N N 0 -5.083 -1.75 -0.069
85 HAU2 H HAU2 N N N 0 -3.657 -1.498 0.966
86 HAT1 H HAT1 N N N 0 -5.579 -2.063 2.374
87 HAS1 H HAS1 N N N 0 -7.87 -1.586 3.089
88 HAS2 H HAS2 N N N 0 -7.429 0.117 3.362
89 HAR2 H HAR2 N N N 0 -9.049 0.775 1.558
90 HAR1 H HAR1 N N N 0 -9.836 -0.029 2.938
91 HBG H HBG N N N 0 -9.167 -1.996 1.024
92 HAE H HAE N N N 0 -16.039 -1.255 -2.46
93 HAM H HAM N N N 0 -11.278 0.891 1.503
94 HAL H HAL N N N 0 -13.473 1.206 0.436
95 HAN H HAN N N N 0 -13.067 -2.568 -1.532
96 HAJ H HAJ N N N 0 -16.252 0.731 -1.423
97 HAK H HAK N N N 0 -10.524 -5.024 0.289
98 HAF H HAF N N N 0 -10.4 -4.404 -2.13