PDBeChem : Atoms of Molecule

Molecule : CTI

Atoms of a chemical element, that composes a molecule

Record	Atom Name	Symbol	PDB Name	Stereochemistry	Is Aromatic	Is Leaving Atom	Charge	X-Coordinate	Y-Coordinate	Z-Coordinate
1	C1	C	C1	N	Y	N	0	2.895	0.937	-0.242
2	C2	C	C2	N	Y	N	0	2.0	-0.098	0.029
3	C3	C	C3	N	Y	N	0	2.516	-1.417	0.131
4	C4	C	C4	N	Y	N	0	3.901	-1.627	0.187
5	C5	C	C5	N	Y	N	0	0.566	0.1	0.242
6	C6	C	C6	N	Y	N	0	-0.262	-1.047	0.163
7	C7	C	C7	N	Y	N	0	0.296	-2.332	0.097
8	C8	C	C8	N	Y	N	0	1.634	-2.519	0.119
9	N9	N	N9	N	Y	N	1	0.005	1.26	0.586
10	C10	C	C10	N	Y	N	0	-1.713	-0.856	0.108
11	C11	C	C11	N	Y	N	0	-2.204	0.468	0.239
12	C12	C	C12	N	Y	N	0	-1.283	1.494	0.507
13	C13	C	C13	N	N	N	0	0.794	2.33	1.204
14	C14	C	C14	N	Y	N	0	-4.441	-0.364	-0.066
15	C15	C	C15	N	Y	N	0	-3.947	-1.664	-0.144
16	C16	C	C16	N	Y	N	0	-2.605	-1.912	-0.063
17	C17	C	C17	N	Y	N	0	-3.582	0.706	0.118
18	O18	O	O18	N	N	N	0	-4.072	1.972	0.18
19	C19	C	C19	N	N	N	0	-4.176	2.689	-1.051
20	O20	O	O20	N	N	N	0	-5.779	-0.145	-0.171
21	C21	C	C21	N	N	N	0	-6.611	-1.291	-0.36
22	C22	C	C22	N	Y	N	0	4.254	0.709	-0.253
23	C23	C	C23	N	Y	N	0	4.762	-0.575	-0.012
24	O24	O	O24	N	N	N	0	5.312	1.543	-0.462
25	C25	C	C25	N	N	N	0	6.45	0.714	-0.734
26	O26	O	O26	N	N	N	0	6.122	-0.493	-0.029
27	H1	H	H1	N	N	N	0	2.547	1.924	-0.513
28	H4	H	H4	N	N	N	0	4.29	-2.616	0.389
29	H7	H	H7	N	N	N	0	-0.354	-3.192	0.025
30	H8	H	H8	N	N	N	0	2.034	-3.522	0.126
31	H12	H	H12	N	N	N	0	-1.635	2.504	0.653
32	H13	H	H13	N	N	N	0	1.203	2.975	0.426
33	H13A	H	H13A	N	N	N	0	0.155	2.917	1.863
34	H13B	H	H13B	N	N	N	0	1.609	1.894	1.781
35	H15	H	H15	N	N	N	0	-4.633	-2.488	-0.271
36	H16	H	H16	N	N	N	0	-2.241	-2.927	-0.131
37	H19	H	H19	N	N	N	0	-3.188	2.779	-1.503
38	H19A	H	H19A	N	N	N	0	-4.838	2.151	-1.73
39	H19B	H	H19B	N	N	N	0	-4.58	3.683	-0.86
40	H21	H	H21	N	N	N	0	-6.325	-1.801	-1.28
41	H21A	H	H21A	N	N	N	0	-6.491	-1.97	0.484
42	H21B	H	H21B	N	N	N	0	-7.653	-0.976	-0.428
43	H25	H	H25	N	N	N	0	6.549	0.525	-1.803
44	H25A	H	H25A	N	N	N	0	7.361	1.162	-0.335

Protein Data Bank
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