4MY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O11	C1	sing	1.43Å	1.44Å
C2	C1	sing	1.53Å	1.53Å
C1	C6	sing	1.53Å	1.53Å
C1	H1	sing	1.09Å	1.10Å
O12	C2	sing	1.43Å	1.44Å
C2	C3	sing	1.53Å	1.53Å
C2	H2	sing	1.09Å	1.10Å
O13	C3	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.53Å
C3	H3	sing	1.09Å	1.10Å
O23	P3	doub	1.48Å	1.51Å
P3	O13	sing	1.61Å	1.62Å
P3	O43	sing	1.61Å	1.52Å
P3	O33	sing	1.61Å	1.52Å
C4	C5	sing	1.53Å	1.54Å
C4	O14	sing	1.43Å	1.43Å
C4	H4	sing	1.09Å	1.10Å
O44	P4	doub	1.48Å	1.51Å
O14	P4	sing	1.61Å	1.62Å
P4	O24	sing	1.61Å	1.52Å
P4	O34	sing	1.61Å	1.51Å
C6	C5	sing	1.53Å	1.53Å
C5	O15	sing	1.43Å	1.43Å
C5	H5	sing	1.09Å	1.10Å
O15	P5	sing	1.61Å	1.62Å
O35	P5	doub	1.48Å	1.51Å
P5	O25	sing	1.61Å	1.52Å
P5	O45	sing	1.61Å	1.51Å
C6	O16	sing	1.43Å	1.43Å
C6	H6	sing	1.09Å	1.10Å
O46	P6	doub	1.48Å	1.52Å
O26	P6	sing	1.61Å	1.51Å
P6	O16	sing	1.61Å	1.62Å
P6	O36	sing	1.61Å	1.51Å
O11	HO11	sing	0.97Å	0.95Å
O12	HO12	sing	0.97Å	0.95Å
O24	HO24	sing	0.97Å	0.95Å
O25	HO25	sing	0.97Å	0.95Å
O26	HO26	sing	0.97Å	0.95Å
O33	HO33	sing	0.97Å	0.95Å
O34	HO34	sing	0.97Å	0.95Å
O36	HO36	sing	0.97Å	0.95Å
O43	HO43	sing	0.97Å	0.95Å
O45	HO45	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O11	C1	C2	109.9°	109.5°
O11	C1	C6	111.3°	109.5°
O11	C1	H1	109.0°	109.5°
C1	O11	HO11	109.5°	114.0°
C2	C1	C6	111.1°	109.5°
C2	C1	H1	107.8°	109.4°
C1	C2	O12	110.6°	109.4°
C1	C2	C3	110.4°	109.5°
C1	C2	H2	108.3°	109.5°
C6	C1	H1	107.7°	109.5°
C1	C6	C5	111.3°	109.5°
C1	C6	O16	111.1°	109.5°
C1	C6	H6	107.7°	109.5°
O12	C2	C3	109.8°	109.5°
O12	C2	H2	109.5°	109.5°
C2	O12	HO12	109.5°	114.0°
C3	C2	H2	108.3°	109.5°
C2	C3	O13	109.5°	109.5°
C2	C3	C4	112.8°	109.5°
C2	C3	H3	108.7°	109.5°
O13	C3	C4	107.2°	109.5°
O13	C3	H3	110.1°	109.4°
C3	O13	P3	122.1°	123.0°
C4	C3	H3	108.7°	109.5°
C3	C4	C5	113.9°	109.4°
C3	C4	O14	107.6°	109.5°
C3	C4	H4	107.6°	109.5°
O23	P3	O13	102.4°	109.5°
O23	P3	O43	113.4°	109.5°
O23	P3	O33	115.0°	109.5°
O13	P3	O43	104.2°	109.5°
O13	P3	O33	104.5°	109.4°
O43	P3	O33	115.3°	109.5°
P3	O43	HO43	109.5°	114.0°
P3	O33	HO33	109.5°	114.0°
C5	C4	O14	111.1°	109.5°
C5	C4	H4	107.6°	109.5°
C4	C5	C6	111.8°	109.5°
C4	C5	O15	108.5°	109.5°
C4	C5	H5	108.9°	109.5°
O14	C4	H4	108.9°	109.5°
C4	O14	P4	122.2°	123.0°
O44	P4	O14	104.8°	109.5°
O44	P4	O24	113.3°	109.5°
O44	P4	O34	113.9°	109.4°
O14	P4	O24	105.6°	109.5°
O14	P4	O34	103.6°	109.5°
O24	P4	O34	114.3°	109.5°
P4	O24	HO24	109.5°	114.1°
P4	O34	HO34	109.5°	114.0°
C6	C5	O15	108.4°	109.4°
C6	C5	H5	108.9°	109.5°
C5	C6	O16	109.8°	109.4°
C5	C6	H6	107.7°	109.5°
O15	C5	H5	110.3°	109.4°
C5	O15	P5	123.6°	123.0°
O15	P5	O35	106.0°	109.5°
O15	P5	O25	102.7°	109.5°
O15	P5	O45	105.0°	109.4°
O35	P5	O25	113.7°	109.5°
O35	P5	O45	112.3°	109.5°
O25	P5	O45	115.9°	109.5°
P5	O25	HO25	109.5°	114.0°
P5	O45	HO45	109.5°	114.0°
O16	C6	H6	109.1°	109.5°
C6	O16	P6	123.5°	123.0°
O46	P6	O26	114.8°	109.5°
O46	P6	O16	103.7°	109.5°
O46	P6	O36	113.9°	109.5°
O26	P6	O16	106.6°	109.5°
O26	P6	O36	113.1°	109.5°
P6	O26	HO26	109.5°	114.0°
O16	P6	O36	103.3°	109.5°
P6	O36	HO36	109.5°	114.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O11	C1	C2	C6	123.6°	120.0°
O11	C1	C2	H1	118.6°	120.0°
O11	C1	C6	H1	119.4°	120.0°
O11	C1	C2	O12	59.8°	60.0°
O11	C1	C2	C3	178.5°	180.0°
O11	C1	C2	H2	60.2°	60.0°
O11	C1	C6	C5	179.3°	180.0°
O11	C1	C6	O16	56.5°	60.0°
O11	C1	C6	H6	62.9°	60.0°
C2	C1	C6	H1	117.8°	120.0°
C1	C2	O12	C3	122.0°	120.0°
C1	C2	O12	H2	119.2°	120.0°
C1	C2	C3	H2	118.3°	120.0°
C1	C2	C3	O13	172.6°	180.0°
C1	C2	C3	C4	53.4°	60.0°
C1	C2	C3	H3	67.1°	60.0°
C2	C1	C6	C5	58.0°	60.0°
C2	C1	C6	O16	179.3°	179.9°
C2	C1	C6	H6	59.9°	60.0°
C2	C1	O11	HO11	180.0°	60.0°
C1	C2	O12	HO12	180.0°	60.0°
C6	C1	C2	O12	63.8°	60.0°
C6	C1	C2	C3	57.9°	60.0°
C6	C1	C2	H2	176.2°	180.0°
C1	C6	C5	C4	52.5°	60.0°
C1	C6	C5	O16	123.5°	120.0°
C1	C6	C5	H6	117.9°	120.0°
C1	C6	C5	O15	172.0°	180.0°
C1	C6	C5	H5	67.9°	60.0°
C1	C6	O16	H6	118.5°	120.0°
C1	C6	O16	P6	111.0°	120.0°
C6	C1	O11	HO11	56.5°	180.0°
H1	C1	C2	O12	178.4°	180.0°
H1	C1	C2	C3	59.9°	60.0°
H1	C1	C2	H2	58.4°	60.0°
H1	C1	C6	C5	59.9°	60.0°
H1	C1	C6	O16	62.9°	60.0°
H1	C1	C6	H6	177.7°	180.0°
H1	C1	O11	HO11	62.1°	60.0°
O12	C2	C3	H2	119.5°	120.0°
O12	C2	C3	O13	50.5°	60.0°
O12	C2	C3	C4	68.7°	60.0°
O12	C2	C3	H3	170.8°	180.0°
C2	C3	O13	C4	122.6°	120.0°
C2	C3	O13	H3	119.4°	120.0°
C2	C3	C4	H3	120.5°	120.0°
C2	C3	O13	P3	96.6°	120.0°
C2	C3	C4	C5	49.5°	60.0°
C2	C3	C4	O14	173.2°	180.0°
C2	C3	C4	H4	69.6°	60.0°
C3	C2	O12	HO12	58.0°	179.9°
H2	C2	C3	O13	69.0°	60.0°
H2	C2	C3	C4	171.8°	180.0°
H2	C2	C3	H3	51.2°	60.0°
H2	C2	O12	HO12	60.8°	59.9°
O13	C3	C4	H3	118.9°	120.0°
C3	O13	P3	O23	91.4°	54.9°
C3	O13	P3	O43	150.3°	175.0°
C3	O13	P3	O33	28.9°	65.0°
O13	C3	C4	C5	170.1°	180.0°
O13	C3	C4	O14	66.3°	60.0°
O13	C3	C4	H4	50.9°	60.0°
C4	C3	O13	P3	140.8°	120.0°
C3	C4	C5	O14	121.7°	120.0°
C3	C4	C5	H4	119.2°	120.0°
C3	C4	O14	H4	116.4°	120.0°
C3	C4	O14	P4	132.3°	120.0°
C3	C4	C5	C6	48.6°	60.0°
C3	C4	C5	O15	168.1°	180.0°
C3	C4	C5	H5	71.8°	60.0°
H3	C3	O13	P3	22.8°	0.0°
H3	C3	C4	C5	71.0°	60.0°
H3	C3	C4	O14	52.6°	60.0°
H3	C3	C4	H4	169.8°	180.0°
O23	P3	O13	O43	118.3°	120.0°
O23	P3	O13	O33	120.2°	120.0°
O23	P3	O43	O33	135.5°	120.0°
O23	P3	O33	HO33	0.0°	180.0°
O23	P3	O43	HO43	0.0°	60.1°
O13	P3	O43	O33	114.0°	120.0°
O13	P3	O33	HO33	111.4°	60.0°
O13	P3	O43	HO43	110.5°	179.9°
O43	P3	O33	HO33	134.8°	60.0°
O33	P3	O43	HO43	135.5°	60.0°
C5	C4	O14	H4	118.3°	120.0°
C5	C4	O14	P4	102.4°	120.0°
C4	C5	C6	O15	119.5°	120.0°
C4	C5	C6	H5	120.4°	120.1°
C4	C5	O15	H5	119.2°	120.0°
C4	C5	O15	P5	129.3°	120.0°
C4	C5	C6	O16	175.9°	180.0°
C4	C5	C6	H6	65.4°	60.0°
C4	O14	P4	O44	11.9°	54.9°
C4	O14	P4	O24	131.8°	175.0°
C4	O14	P4	O34	107.8°	65.0°
O14	C4	C5	C6	170.3°	180.0°
O14	C4	C5	O15	70.2°	60.0°
O14	C4	C5	H5	49.9°	60.0°
H4	C4	O14	P4	15.9°	0.1°
H4	C4	C5	C6	70.6°	60.0°
H4	C4	C5	O15	48.9°	60.0°
H4	C4	C5	H5	169.0°	179.9°
O44	P4	O14	O24	119.9°	120.1°
O44	P4	O14	O34	119.7°	120.0°
O44	P4	O24	O34	132.6°	120.0°
O44	P4	O24	HO24	0.0°	60.0°
O44	P4	O34	HO34	0.0°	180.0°
O14	P4	O24	O34	113.2°	120.0°
O14	P4	O24	HO24	114.2°	180.0°
O14	P4	O34	HO34	113.3°	60.0°
O24	P4	O34	HO34	132.3°	60.0°
O34	P4	O24	HO24	132.6°	60.0°
C6	C5	O15	H5	119.2°	120.0°
C6	C5	O15	P5	109.1°	120.1°
C5	C6	O16	H6	117.8°	120.0°
C5	C6	O16	P6	125.4°	120.1°
C5	O15	P5	O35	63.1°	54.9°
C5	O15	P5	O25	177.4°	175.0°
C5	O15	P5	O45	55.9°	65.1°
O15	C5	C6	O16	64.5°	60.0°
O15	C5	C6	H6	54.1°	60.0°
H5	C5	O15	P5	10.1°	0.1°
H5	C5	C6	O16	55.6°	59.9°
H5	C5	C6	H6	174.2°	179.9°
O15	P5	O35	O25	112.0°	120.0°
O15	P5	O35	O45	114.1°	120.0°
O15	P5	O25	O45	113.8°	119.9°
O15	P5	O25	HO25	114.0°	180.0°
O15	P5	O45	HO45	114.7°	60.0°
O35	P5	O25	O45	132.2°	120.0°
O35	P5	O25	HO25	0.0°	60.0°
O35	P5	O45	HO45	0.0°	180.0°
O25	P5	O45	HO45	132.8°	60.0°
O45	P5	O25	HO25	132.2°	60.0°
C6	O16	P6	O46	105.6°	55.0°
C6	O16	P6	O26	15.9°	65.1°
C6	O16	P6	O36	135.3°	175.0°
H6	C6	O16	P6	7.6°	0.1°
O46	P6	O26	O16	114.2°	120.0°
O46	P6	O26	O36	133.0°	120.0°
O46	P6	O16	O36	119.1°	120.0°
O46	P6	O26	HO26	0.0°	180.0°
O46	P6	O36	HO36	0.0°	60.1°
O26	P6	O16	O36	119.4°	120.0°
O26	P6	O36	HO36	133.4°	60.0°
O16	P6	O26	HO26	114.2°	60.0°
O16	P6	O36	HO36	111.8°	179.9°
O36	P6	O26	HO26	133.0°	60.0°

Definition date:	2012-06-12
Last modified:	2012-06-29
Release status:	REL
Processing site:	EBI
Derived from:	4AXF