11P

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C17	C16	sing	1.54Å	1.53Å
C17	C23	sing	1.51Å	1.51Å
C16	C3	sing	1.54Å	1.54Å
O10	P1	doub	1.48Å	1.51Å
O9	P1	sing	1.61Å	1.52Å
C23	C26	doub	1.39Å	1.39Å	Aromatic
C23	C27	sing	1.39Å	1.37Å	Aromatic
C3	C27	sing	1.51Å	1.49Å
C3	C1	sing	1.53Å	1.54Å
P1	C1	sing	1.82Å	1.82Å
P1	O8	sing	1.61Å	1.51Å
C26	C29	sing	1.38Å	1.39Å	Aromatic
C27	C28	doub	1.38Å	1.39Å	Aromatic
C1	O2	sing	1.43Å	1.33Å
C1	P4	sing	1.82Å	1.82Å
O6	P4	doub	1.48Å	1.52Å
C29	N25	doub	1.32Å	1.35Å	Aromatic
C28	N25	sing	1.32Å	1.35Å	Aromatic
P4	O5	sing	1.61Å	1.52Å
P4	O7	sing	1.61Å	1.51Å
O5	HO5	sing	0.97Å	0.95Å
O7	HO7	sing	0.97Å	0.95Å
O8	HO8	sing	0.97Å	0.95Å
O2	HO2	sing	0.97Å	0.95Å
O9	HO9	sing	0.97Å	0.95Å
C3	H3	sing	1.09Å	1.10Å
C16	H161	sing	1.09Å	1.10Å
C16	H162	sing	1.09Å	1.10Å
C17	H171	sing	1.09Å	1.10Å
C17	H172	sing	1.09Å	1.10Å
C26	H26	sing	1.08Å	1.08Å
C29	H29	sing	1.08Å	1.08Å
C28	H28	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C16	C17	C23	102.3°	105.2°
C17	C16	C3	106.7°	102.5°
C17	C16	H161	110.4°	110.8°
C17	C16	H162	111.0°	111.0°
C16	C17	H171	111.9°	110.3°
C16	C17	H172	113.4°	110.3°
C17	C23	C26	127.5°	131.5°
C17	C23	C27	111.6°	109.9°
C23	C17	H171	112.0°	110.3°
C23	C17	H172	113.5°	110.3°
C16	C3	C27	103.6°	105.2°
C16	C3	C1	116.1°	110.3°
C16	C3	H3	112.1°	110.3°
C3	C16	H161	110.4°	110.8°
C3	C16	H162	111.0°	110.8°
O10	P1	O9	109.8°	109.5°
O10	P1	C1	107.8°	109.5°
O10	P1	O8	115.3°	109.4°
O9	P1	C1	107.2°	109.5°
O9	P1	O8	112.3°	109.4°
P1	O9	HO9	109.5°	114.0°
C26	C23	C27	120.8°	118.6°
C23	C26	C29	117.0°	119.1°
C23	C26	H26	121.5°	120.4°
C23	C27	C3	110.6°	109.6°
C23	C27	C28	120.2°	119.1°
C27	C3	C1	116.8°	110.3°
C3	C27	C28	129.2°	131.3°
C27	C3	H3	111.3°	110.3°
C3	C1	P1	111.4°	109.4°
C3	C1	O2	103.8°	109.5°
C3	C1	P4	120.4°	109.5°
C1	C3	H3	97.3°	110.3°
C1	P1	O8	103.9°	109.5°
P1	C1	O2	108.3°	109.5°
P1	C1	P4	105.9°	109.5°
P1	O8	HO8	109.5°	114.0°
C26	C29	N25	121.5°	120.7°
C29	C26	H26	121.5°	120.5°
C26	C29	H29	119.3°	119.7°
C27	C28	N25	118.7°	120.7°
C27	C28	H28	120.7°	119.6°
O2	C1	P4	106.5°	109.5°
C1	O2	HO2	109.5°	114.0°
C1	P4	O6	104.7°	109.5°
C1	P4	O5	113.9°	109.5°
C1	P4	O7	102.9°	109.5°
O6	P4	O5	113.5°	109.5°
O6	P4	O7	112.8°	109.4°
C29	N25	C28	121.9°	121.8°
N25	C29	H29	119.3°	119.6°
N25	C28	H28	120.7°	119.6°
O5	P4	O7	108.6°	109.5°
P4	O5	HO5	109.5°	114.0°
P4	O7	HO7	109.5°	114.0°
H161	C16	H162	107.4°	110.7°
H171	C17	H172	104.1°	110.3°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C16	C17	C23	H171	120.0°	118.9°
C16	C17	C23	H172	122.6°	119.0°
C17	C16	C3	H161	120.0°	118.2°
C17	C16	C3	H162	121.1°	118.5°
C16	C17	C23	C26	165.9°	162.9°
C16	C17	C23	C27	13.6°	17.0°
C17	C16	C3	C27	21.8°	26.2°
C17	C16	C3	C1	151.2°	145.1°
C17	C16	C3	H3	98.2°	92.8°
C17	C16	H161	H162	121.1°	123.6°
C16	C17	H171	H172	122.9°	122.1°
C23	C17	C16	C3	21.4°	26.1°
C17	C23	C26	C27	179.4°	180.0°
C17	C23	C27	C3	0.1°	0.0°
C17	C23	C26	C29	179.8°	180.0°
C17	C23	C27	C28	179.9°	180.0°
C23	C17	C16	H161	141.4°	92.1°
C23	C17	C16	H162	99.6°	144.5°
C23	C17	H171	H172	122.9°	122.1°
C17	C23	C26	H26	0.2°	0.0°
C16	C3	C27	C23	13.7°	17.1°
C16	C3	C27	C1	128.9°	119.0°
C16	C3	C27	H3	120.6°	119.0°
C16	C3	C1	H3	119.0°	122.1°
C16	C3	C1	P1	49.4°	57.6°
C16	C3	C27	C28	166.3°	162.9°
C16	C3	C1	O2	165.7°	177.6°
C16	C3	C1	P4	75.4°	62.4°
C3	C16	H161	H162	121.1°	123.4°
C3	C16	C17	H171	141.5°	145.0°
C3	C16	C17	H172	101.2°	92.9°
O10	P1	O9	C1	116.8°	120.0°
O10	P1	O9	O8	129.7°	119.9°
O10	P1	C1	C3	41.5°	172.8°
O10	P1	C1	O8	122.8°	120.0°
O10	P1	C1	O2	72.1°	52.8°
O10	P1	C1	P4	174.0°	67.2°
O10	P1	O8	HO8	52.5°	59.9°
O10	P1	O9	HO9	2.7°	170.4°
O9	P1	C1	C3	76.6°	52.8°
O9	P1	C1	O8	119.0°	120.0°
O9	P1	C1	O2	169.8°	67.2°
O9	P1	C1	P4	55.9°	172.7°
O9	P1	O8	HO8	74.3°	60.0°
C26	C23	C27	C3	179.6°	180.0°
C23	C26	C29	H26	180.0°	180.0°
C26	C23	C27	C28	0.4°	0.0°
C23	C26	C29	N25	0.3°	0.0°
C26	C23	C17	H171	45.9°	44.0°
C26	C23	C17	H172	71.6°	78.1°
C23	C26	C29	H29	179.7°	180.0°
C23	C27	C3	C28	180.0°	180.0°
C23	C27	C3	C1	142.7°	136.0°
C27	C23	C26	C29	0.4°	0.0°
C23	C27	C28	N25	0.3°	0.0°
C23	C27	C3	H3	106.9°	101.9°
C27	C23	C17	H171	133.5°	136.0°
C27	C23	C17	H172	109.0°	101.9°
C27	C23	C26	H26	179.6°	180.0°
C23	C27	C28	H28	179.7°	180.0°
C27	C3	C1	H3	118.3°	122.0°
C27	C3	C1	P1	172.0°	58.3°
C27	C3	C1	O2	71.6°	61.8°
C27	C3	C1	P4	47.3°	178.2°
C3	C27	C28	N25	179.8°	180.0°
C27	C3	C16	H161	141.8°	92.1°
C27	C3	C16	H162	99.2°	144.6°
C3	C27	C28	H28	0.3°	0.0°
C3	C1	P1	O2	113.6°	120.0°
C3	C1	P1	P4	132.5°	120.0°
C3	C1	P1	O8	164.4°	67.2°
C1	C3	C27	C28	37.3°	44.0°
C3	C1	O2	P4	128.0°	120.0°
C3	C1	P4	O6	73.4°	63.0°
C3	C1	P4	O5	51.1°	176.9°
C3	C1	P4	O7	168.5°	56.9°
C3	C1	O2	HO2	131.3°	60.0°
C1	C3	C16	H161	88.8°	26.9°
C1	C3	C16	H162	30.1°	96.4°
P1	C1	O2	P4	113.5°	120.0°
P1	C1	P4	O6	53.9°	56.9°
P1	C1	P4	O5	178.4°	63.1°
P1	C1	P4	O7	64.3°	176.9°
C1	P1	O8	HO8	170.2°	180.0°
P1	C1	O2	HO2	110.2°	180.0°
C1	P1	O9	HO9	114.2°	69.6°
P1	C1	C3	H3	69.6°	179.7°
O8	P1	C1	O2	50.8°	172.8°
O8	P1	C1	P4	63.1°	52.7°
O8	P1	O9	HO9	132.4°	50.5°
C26	C29	N25	H29	180.0°	180.0°
C26	C29	N25	C28	0.1°	0.0°
C27	C28	N25	C29	0.1°	0.0°
C27	C28	N25	H28	180.0°	180.0°
C28	C27	C3	H3	73.1°	78.1°
O2	C1	P4	O6	169.0°	177.0°
O2	C1	P4	O5	66.5°	56.9°
O2	C1	P4	O7	50.9°	63.1°
O2	C1	C3	H3	46.7°	60.3°
C1	P4	O6	O5	124.8°	120.0°
C1	P4	O6	O7	111.1°	120.0°
C1	P4	O5	O7	114.0°	120.0°
C1	P4	O5	HO5	121.4°	180.0°
C1	P4	O7	HO7	55.3°	65.1°
P4	C1	O2	HO2	3.3°	60.0°
P4	C1	C3	H3	165.7°	59.7°
O6	P4	O5	O7	126.3°	120.0°
O6	P4	O5	HO5	118.9°	60.0°
O6	P4	O7	HO7	57.0°	174.9°
N25	C29	C26	H26	179.7°	180.0°
C29	N25	C28	H28	179.9°	180.0°
C28	N25	C29	H29	179.9°	180.0°
O5	P4	O7	HO7	176.3°	54.9°
O7	P4	O5	HO5	7.4°	60.0°
H3	C3	C16	H161	21.7°	149.0°
H3	C3	C16	H162	140.7°	25.7°
H161	C16	C17	H171	98.6°	26.8°
H161	C16	C17	H172	18.8°	148.9°
H162	C16	C17	H171	20.4°	96.6°
H162	C16	C17	H172	137.8°	25.5°
H26	C26	C29	H29	0.3°	0.0°

Definition date:	2007-09-18
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	2RAH