A1AEP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C02	O01	sing	1.43Å	0.00Å
C03	C02	sing	1.54Å	0.00Å
P05	O04	sing	1.61Å	0.00Å
O06	P05	doub	1.48Å	0.00Å
O07	P05	sing	1.61Å	0.00Å
O04	C03	sing	1.43Å	0.00Å
C08	C03	sing	1.54Å	0.00Å
O10	C09	sing	1.43Å	0.00Å
P11	O10	sing	1.61Å	0.00Å
C13	O12	sing	1.43Å	0.00Å
C14	C13	sing	1.54Å	0.00Å
O15	C14	sing	1.43Å	0.00Å
C16	C14	sing	1.54Å	0.00Å
C18	N17	sing	1.35Å	0.00Å
C20	N19	sing	1.35Å	0.00Å
C22	C21	doub	1.35Å	0.00Å
C21	C20	sing	1.42Å	0.00Å
O23	C20	doub	1.22Å	0.00Å
N19	C18	sing	1.35Å	0.00Å
O24	C18	doub	1.22Å	0.00Å
N17	C16	sing	1.47Å	0.00Å
O25	C16	sing	1.43Å	0.00Å
C26	O25	sing	1.43Å	0.00Å
C27	C26	sing	1.53Å	0.00Å
O28	C27	sing	1.43Å	0.00Å
O12	P11	sing	1.61Å	0.00Å
O29	P11	doub	1.48Å	0.00Å
O30	P11	sing	1.61Å	0.00Å
C09	C08	sing	1.53Å	0.00Å
O31	C08	sing	1.43Å	0.00Å
C32	O31	sing	1.43Å	0.00Å
N33	C32	sing	1.46Å	0.00Å
C34	N33	sing	1.37Å	0.00Å	Aromatic
C36	N35	doub	1.32Å	0.00Å	Aromatic
N37	C36	sing	1.32Å	0.00Å	Aromatic
C38	N37	doub	1.33Å	0.00Å	Aromatic
N39	C38	sing	1.38Å	0.00Å
N35	C34	sing	1.33Å	0.00Å	Aromatic
C40	C34	doub	1.40Å	0.00Å	Aromatic
N41	C40	sing	1.36Å	0.00Å	Aromatic
C42	N41	doub	1.30Å	0.00Å	Aromatic
C02	C32	sing	1.54Å	0.00Å
P05	O28	sing	1.61Å	0.00Å
C13	C26	sing	1.54Å	0.00Å
N17	C22	sing	1.37Å	0.00Å
N33	C42	sing	1.36Å	0.00Å	Aromatic
C38	C40	sing	1.41Å	0.00Å	Aromatic
C13	H131	sing	1.09Å	0.00Å
C21	H211	sing	1.08Å	0.00Å
C22	H221	sing	1.08Å	0.00Å
C26	H261	sing	1.09Å	0.00Å
C02	H021	sing	1.09Å	0.00Å
C03	H031	sing	1.09Å	0.00Å
C08	H081	sing	1.09Å	0.00Å
C09	H091	sing	1.09Å	0.00Å
C09	H092	sing	1.09Å	0.00Å
C14	H141	sing	1.09Å	0.00Å
C16	H161	sing	1.09Å	0.00Å
C27	H272	sing	1.09Å	0.00Å
C27	H271	sing	1.09Å	0.00Å
C32	H321	sing	1.09Å	0.00Å
C36	H361	sing	1.08Å	0.00Å
C42	H421	sing	1.08Å	0.00Å
N19	H191	sing	0.97Å	0.00Å
N39	H391	sing	0.97Å	0.00Å
N39	H392	sing	0.97Å	0.00Å
O01	H011	sing	0.97Å	0.00Å
O07	H1	sing	0.97Å	0.00Å
O15	H151	sing	0.97Å	0.00Å
O30	H2	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O01	C02	C03	90.0°	110.4°
O01	C02	C32	90.0°	110.4°
O01	C02	H021	90.0°	110.5°
C02	O01	H011	90.0°	114.0°
C02	C03	O04	90.0°	110.4°
C02	C03	C08	90.0°	105.2°
C03	C02	C32	90.0°	104.5°
C03	C02	H021	90.0°	110.5°
C02	C03	H031	90.0°	110.0°
O04	P05	O06	90.0°	109.5°
O04	P05	O07	90.0°	109.5°
P05	O04	C03	90.0°	123.4°
O04	P05	O28	90.0°	109.5°
O06	P05	O07	90.0°	109.4°
O06	P05	O28	90.0°	109.5°
O07	P05	O28	90.0°	109.5°
P05	O07	H1	90.0°	114.0°
O04	C03	C08	90.0°	110.5°
O04	C03	H031	90.0°	110.4°
C03	C08	C09	90.0°	109.8°
C03	C08	O31	90.0°	108.4°
C08	C03	H031	90.0°	110.2°
C03	C08	H081	90.0°	109.6°
C09	O10	P11	90.0°	123.3°
O10	C09	C08	90.0°	109.2°
O10	C09	H091	90.0°	109.7°
O10	C09	H092	90.0°	109.5°
O10	P11	O12	90.0°	109.5°
O10	P11	O29	90.0°	109.5°
O10	P11	O30	90.0°	109.4°
O12	C13	C14	90.0°	110.4°
C13	O12	P11	90.0°	123.3°
O12	C13	C26	90.0°	110.4°
O12	C13	H131	90.0°	110.5°
C13	C14	O15	90.0°	110.4°
C13	C14	C16	90.0°	105.0°
C14	C13	C26	90.0°	105.0°
C14	C13	H131	90.0°	110.0°
C13	C14	H141	90.0°	110.3°
O15	C14	C16	90.0°	110.4°
O15	C14	H141	90.0°	110.3°
C14	O15	H151	90.0°	114.1°
C14	C16	N17	90.0°	109.7°
C14	C16	O25	90.0°	108.1°
C16	C14	H141	90.0°	110.2°
C14	C16	H161	90.0°	109.8°
N17	C18	N19	90.0°	120.9°
N17	C18	O24	90.0°	119.6°
C18	N17	C16	90.0°	119.6°
C18	N17	C22	90.0°	120.7°
N19	C20	C21	90.0°	119.4°
N19	C20	O23	90.0°	120.2°
C20	N19	C18	90.0°	120.2°
C20	N19	H191	90.0°	119.9°
C22	C21	C20	90.0°	119.1°
C21	C22	N17	90.0°	119.7°
C22	C21	H211	90.0°	120.4°
C21	C22	H221	90.0°	120.1°
C21	C20	O23	90.0°	120.4°
C20	C21	H211	90.0°	120.4°
N19	C18	O24	90.0°	119.5°
C18	N19	H191	90.0°	119.9°
N17	C16	O25	90.0°	109.7°
C16	N17	C22	90.0°	119.7°
N17	C16	H161	90.0°	109.7°
C16	O25	C26	90.0°	109.8°
O25	C16	H161	90.0°	109.8°
O25	C26	C27	90.0°	109.9°
O25	C26	C13	90.0°	107.8°
O25	C26	H261	90.0°	109.7°
C26	C27	O28	90.0°	109.6°
C27	C26	C13	90.0°	109.9°
C27	C26	H261	90.0°	109.8°
C26	C27	H272	90.0°	109.5°
C26	C27	H271	90.0°	109.4°
C27	O28	P05	90.0°	123.1°
O28	C27	H272	90.0°	109.5°
O28	C27	H271	90.0°	109.5°
O12	P11	O29	90.0°	109.6°
O12	P11	O30	90.0°	109.4°
O29	P11	O30	90.0°	109.4°
P11	O30	H2	90.0°	114.0°
C09	C08	O31	90.0°	110.1°
C09	C08	H081	90.0°	109.5°
C08	C09	H091	90.0°	109.5°
C08	C09	H092	90.0°	109.5°
C08	O31	C32	90.0°	110.1°
O31	C08	H081	90.0°	109.4°
O31	C32	N33	90.0°	109.8°
O31	C32	C02	90.0°	107.8°
O31	C32	H321	90.0°	109.8°
C32	N33	C34	90.0°	126.3°
N33	C32	C02	90.0°	109.8°
C32	N33	C42	90.0°	126.3°
N33	C32	H321	90.0°	109.8°
N33	C34	N35	90.0°	134.9°
N33	C34	C40	90.0°	106.0°
C34	N33	C42	90.0°	107.4°
N35	C36	N37	90.0°	122.5°
C36	N35	C34	90.0°	120.6°
N35	C36	H361	90.0°	118.8°
C36	N37	C38	90.0°	121.2°
N37	C36	H361	90.0°	118.8°
N37	C38	N39	90.0°	120.8°
N37	C38	C40	90.0°	118.5°
N39	C38	C40	90.0°	120.8°
C38	N39	H391	90.0°	120.0°
C38	N39	H392	90.0°	120.0°
N35	C34	C40	90.0°	119.1°
C34	C40	N41	90.0°	107.1°
C34	C40	C38	90.0°	118.2°
C40	N41	C42	90.0°	109.4°
N41	C40	C38	90.0°	134.7°
N41	C42	N33	90.0°	110.0°
N41	C42	H421	90.0°	125.0°
C32	C02	H021	90.0°	110.4°
C02	C32	H321	90.0°	109.8°
C26	C13	H131	90.0°	110.3°
C13	C26	H261	90.0°	109.8°
N17	C22	H221	90.0°	120.2°
N33	C42	H421	90.0°	125.0°
H091	C09	H092	90.0°	109.5°
H272	C27	H271	90.0°	109.3°
H391	N39	H392	90.0°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O01	C02	C03	C32	90.0°	118.7°
O01	C02	C03	H021	90.0°	122.5°
O01	C02	C03	O04	90.0°	9.1°
O01	C02	C03	C08	90.0°	128.2°
O01	C02	C32	O31	90.0°	137.2°
O01	C02	C32	N33	90.0°	103.2°
O01	C02	C32	H021	90.0°	122.5°
O01	C02	C03	H031	90.0°	113.0°
O01	C02	C32	H321	90.0°	17.7°
C02	C03	O04	P05	90.0°	167.2°
C02	C03	O04	C08	90.0°	115.9°
C02	C03	O04	H031	90.0°	121.9°
C02	C03	C08	H031	90.0°	118.6°
C02	C03	C08	C09	90.0°	122.7°
C02	C03	C08	O31	90.0°	2.4°
C03	C02	C32	O31	90.0°	18.5°
C03	C02	C32	N33	90.0°	138.1°
C03	C02	C32	H021	90.0°	118.8°
C02	C03	C08	H081	90.0°	117.0°
C03	C02	C32	H321	90.0°	101.1°
C03	C02	O01	H011	90.0°	176.5°
O04	P05	O06	O07	90.0°	120.0°
O04	P05	O06	O28	90.0°	120.1°
O04	P05	O07	O28	90.0°	120.1°
P05	O04	C03	C08	90.0°	76.8°
O04	P05	O28	C27	90.0°	153.7°
P05	O04	C03	H031	90.0°	45.3°
O04	P05	O07	H1	90.0°	180.0°
O06	P05	O07	O28	90.0°	119.9°
O06	P05	O04	C03	90.0°	144.0°
O06	P05	O28	C27	90.0°	33.6°
O06	P05	O07	H1	90.0°	60.0°
O07	P05	O04	C03	90.0°	96.1°
O07	P05	O28	C27	90.0°	86.2°
O04	C03	C08	H031	90.0°	122.2°
O04	C03	C08	C09	90.0°	118.1°
O04	C03	C08	O31	90.0°	121.6°
O04	C03	C02	C32	90.0°	109.7°
C03	O04	P05	O28	90.0°	23.9°
O04	C03	C02	H021	90.0°	131.6°
O04	C03	C08	H081	90.0°	2.2°
C03	C08	C09	O10	90.0°	85.7°
C03	C08	C09	O31	90.0°	119.3°
C03	C08	C09	H081	90.0°	120.4°
C03	C08	O31	H081	90.0°	119.5°
C03	C08	O31	C32	90.0°	14.7°
C08	C03	C02	C32	90.0°	9.5°
C08	C03	C02	H021	90.0°	109.2°
C03	C08	C09	H091	90.0°	34.3°
C03	C08	C09	H092	90.0°	154.4°
C09	O10	P11	O12	90.0°	165.2°
C09	O10	P11	O29	90.0°	45.1°
C09	O10	P11	O30	90.0°	74.9°
O10	C09	C08	H091	90.0°	120.1°
O10	C09	C08	H092	90.0°	119.9°
O10	C09	C08	O31	90.0°	155.0°
O10	C09	C08	H081	90.0°	34.6°
O10	C09	H091	H092	90.0°	120.2°
O10	P11	O12	C13	90.0°	87.6°
O10	P11	O12	O29	90.0°	120.1°
O10	P11	O12	O30	90.0°	119.9°
O10	P11	O29	O30	90.0°	119.9°
P11	O10	C09	C08	90.0°	175.9°
P11	O10	C09	H091	90.0°	55.9°
P11	O10	C09	H092	90.0°	64.3°
O10	P11	O30	H2	90.0°	60.1°
O12	C13	C14	C26	90.0°	119.0°
O12	C13	C14	H131	90.0°	122.3°
O12	C13	C14	O15	90.0°	2.5°
O12	C13	C14	C16	90.0°	121.5°
O12	C13	C26	O25	90.0°	133.2°
O12	C13	C26	C27	90.0°	107.1°
C13	O12	P11	O29	90.0°	32.5°
C13	O12	P11	O30	90.0°	152.5°
O12	C13	C26	H131	90.0°	122.4°
O12	C13	C26	H261	90.0°	13.8°
O12	C13	C14	H141	90.0°	119.7°
C13	C14	O15	C16	90.0°	115.7°
C13	C14	O15	H141	90.0°	122.3°
C13	C14	C16	H141	90.0°	118.8°
C13	C14	C16	N17	90.0°	129.6°
C13	C14	C16	O25	90.0°	10.0°
C14	C13	C26	O25	90.0°	14.2°
C14	C13	C26	C27	90.0°	133.9°
C14	C13	O12	P11	90.0°	137.6°
C14	C13	C26	H131	90.0°	118.5°
C14	C13	C26	H261	90.0°	105.3°
C13	C14	C16	H161	90.0°	109.7°
C13	C14	O15	H151	90.0°	180.0°
O15	C14	C16	H141	90.0°	122.1°
O15	C14	C16	N17	90.0°	111.3°
O15	C14	C16	O25	90.0°	129.0°
O15	C14	C13	C26	90.0°	116.5°
O15	C14	C13	H131	90.0°	124.8°
O15	C14	C16	H161	90.0°	9.3°
C14	C16	N17	C18	90.0°	115.0°
C14	C16	N17	O25	90.0°	118.6°
C14	C16	N17	H161	90.0°	120.7°
C14	C16	O25	H161	90.0°	119.7°
C14	C16	O25	C26	90.0°	19.8°
C16	C14	C13	C26	90.0°	2.5°
C14	C16	N17	C22	90.0°	65.0°
C16	C14	C13	H131	90.0°	116.2°
C16	C14	O15	H151	90.0°	64.3°
N17	C18	N19	C20	90.0°	0.0°
C18	N17	C22	C21	90.0°	0.1°
N17	C18	N19	O24	90.0°	180.0°
C18	N17	C16	C22	90.0°	180.0°
C18	N17	C16	O25	90.0°	126.4°
C18	N17	C22	H221	90.0°	180.0°
C18	N17	C16	H161	90.0°	5.7°
N17	C18	N19	H191	90.0°	180.0°
N19	C20	C21	C22	90.0°	0.1°
N19	C20	C21	O23	90.0°	179.7°
C20	N19	C18	H191	90.0°	180.0°
C20	N19	C18	O24	90.0°	180.0°
N19	C20	C21	H211	90.0°	180.0°
C22	C21	C20	H211	90.0°	179.9°
C22	C21	C20	O23	90.0°	179.8°
C21	C22	N17	C16	90.0°	180.0°
C21	C22	N17	H221	90.0°	179.9°
C21	C20	N19	C18	90.0°	0.1°
C20	C21	C22	N17	90.0°	0.1°
C20	C21	C22	H221	90.0°	179.9°
C21	C20	N19	H191	90.0°	180.0°
O23	C20	N19	C18	90.0°	179.7°
O23	C20	C21	H211	90.0°	0.4°
O23	C20	N19	H191	90.0°	0.3°
N19	C18	N17	C16	90.0°	180.0°
N19	C18	N17	C22	90.0°	0.1°
O24	C18	N17	C16	90.0°	0.0°
O24	C18	N17	C22	90.0°	180.0°
O24	C18	N19	H191	90.0°	0.0°
N17	C16	O25	H161	90.0°	120.7°
N17	C16	O25	C26	90.0°	139.4°
C16	N17	C22	H221	90.0°	0.0°
N17	C16	C14	H141	90.0°	10.8°
C16	O25	C26	C27	90.0°	141.1°
C16	O25	C26	C13	90.0°	21.4°
O25	C16	N17	C22	90.0°	53.7°
C16	O25	C26	H261	90.0°	98.1°
O25	C16	C14	H141	90.0°	108.8°
O25	C26	C27	C13	90.0°	118.4°
O25	C26	C27	H261	90.0°	120.8°
O25	C26	C27	O28	90.0°	161.3°
O25	C26	C13	H261	90.0°	119.4°
O25	C26	C13	H131	90.0°	104.4°
C26	O25	C16	H161	90.0°	99.9°
O25	C26	C27	H272	90.0°	78.5°
O25	C26	C27	H271	90.0°	41.2°
C26	C27	O28	H272	90.0°	120.2°
C26	C27	O28	H271	90.0°	120.0°
C26	C27	O28	P05	90.0°	94.1°
C27	C26	C13	H261	90.0°	120.9°
C27	C26	C13	H131	90.0°	15.4°
C26	C27	H272	H271	90.0°	119.8°
O28	C27	C26	C13	90.0°	80.3°
O28	C27	C26	H261	90.0°	40.5°
O28	C27	H272	H271	90.0°	120.0°
O12	P11	O29	O30	90.0°	120.0°
P11	O12	C13	C26	90.0°	106.7°
P11	O12	C13	H131	90.0°	15.6°
O12	P11	O30	H2	90.0°	180.0°
O29	P11	O30	H2	90.0°	59.9°
C09	C08	O31	H081	90.0°	120.4°
C09	C08	O31	C32	90.0°	134.8°
C09	C08	C03	H031	90.0°	4.1°
C08	C09	H091	H092	90.0°	120.0°
C08	O31	C32	N33	90.0°	140.6°
C08	O31	C32	C02	90.0°	21.0°
O31	C08	C03	H031	90.0°	116.2°
O31	C08	C09	H091	90.0°	85.0°
O31	C08	C09	H092	90.0°	35.1°
C08	O31	C32	H321	90.0°	98.5°
O31	C32	N33	C02	90.0°	118.4°
O31	C32	N33	H321	90.0°	120.8°
O31	C32	N33	C34	90.0°	156.6°
O31	C32	C02	H321	90.0°	119.6°
O31	C32	N33	C42	90.0°	23.4°
O31	C32	C02	H021	90.0°	100.3°
C32	O31	C08	H081	90.0°	104.8°
C32	N33	C34	C42	90.0°	180.0°
C32	N33	C34	N35	90.0°	0.3°
C32	N33	C34	C40	90.0°	180.0°
C32	N33	C42	N41	90.0°	180.0°
N33	C32	C02	H321	90.0°	120.8°
N33	C32	C02	H021	90.0°	19.3°
C32	N33	C42	H421	90.0°	0.0°
N33	C34	N35	C36	90.0°	180.0°
N33	C34	N35	C40	90.0°	179.6°
N33	C34	C40	N41	90.0°	0.0°
C34	N33	C42	N41	90.0°	0.0°
C34	N33	C32	C02	90.0°	85.0°
N33	C34	C40	C38	90.0°	180.0°
C34	N33	C32	H321	90.0°	35.8°
C34	N33	C42	H421	90.0°	180.0°
N35	C36	N37	H361	90.0°	179.9°
N35	C36	N37	C38	90.0°	0.4°
C36	N35	C34	C40	90.0°	0.3°
C36	N37	C38	N39	90.0°	180.0°
N37	C36	N35	C34	90.0°	0.0°
C36	N37	C38	C40	90.0°	0.5°
N37	C38	N39	C40	90.0°	179.5°
N37	C38	C40	C34	90.0°	0.2°
N37	C38	C40	N41	90.0°	179.8°
C38	N37	C36	H361	90.0°	179.5°
N37	C38	N39	H391	90.0°	0.1°
N37	C38	N39	H392	90.0°	180.0°
N39	C38	C40	C34	90.0°	179.7°
N39	C38	C40	N41	90.0°	0.3°
C38	N39	H391	H392	90.0°	180.0°
N35	C34	C40	N41	90.0°	179.8°
N35	C34	N33	C42	90.0°	179.7°
N35	C34	C40	C38	90.0°	0.2°
C34	N35	C36	H361	90.0°	180.0°
C34	C40	N41	C38	90.0°	180.0°
C34	C40	N41	C42	90.0°	0.0°
C40	C34	N33	C42	90.0°	0.0°
C40	N41	C42	N33	90.0°	0.0°
C40	N41	C42	H421	90.0°	180.0°
N41	C42	N33	H421	90.0°	180.0°
C42	N41	C40	C38	90.0°	180.0°
C02	C32	N33	C42	90.0°	95.0°
C32	C02	C03	H031	90.0°	128.2°
C32	C02	O01	H011	90.0°	61.5°
P05	O28	C27	H272	90.0°	145.8°
P05	O28	C27	H271	90.0°	25.9°
O28	P05	O07	H1	90.0°	59.9°
C26	C13	C14	H141	90.0°	121.2°
C13	C26	C27	H272	90.0°	39.9°
C13	C26	C27	H271	90.0°	159.6°
N17	C22	C21	H211	90.0°	180.0°
C22	N17	C16	H161	90.0°	174.4°
C42	N33	C32	H321	90.0°	144.2°
C40	C38	N39	H391	90.0°	179.5°
C40	C38	N39	H392	90.0°	0.5°
H131	C13	C26	H261	90.0°	136.2°
H131	C13	C14	H141	90.0°	2.5°
H211	C21	C22	H221	90.0°	0.1°
H261	C26	C27	H272	90.0°	160.7°
H261	C26	C27	H271	90.0°	79.5°
H021	C02	C03	H031	90.0°	9.5°
H021	C02	C32	H321	90.0°	140.2°
H021	C02	O01	H011	90.0°	60.9°
H031	C03	C08	H081	90.0°	124.5°
H081	C08	C09	H091	90.0°	154.7°
H081	C08	C09	H092	90.0°	85.3°
H141	C14	C16	H161	90.0°	131.4°
H141	C14	O15	H151	90.0°	57.8°

Release date:	2025-05-21
Definition date:	2024-02-13
Last modified:	2025-05-16
Release status:	REL
Processing site:	RCSB