1X4

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C2	C3	sing	1.55Å	1.53Å
C2	C1	sing	1.55Å	1.52Å
C3	C4	sing	1.54Å	1.52Å
C1	O1	sing	1.43Å	1.42Å
C1	O4	sing	1.44Å	1.42Å
C4	O4	sing	1.43Å	1.44Å
C4	C5	sing	1.53Å	1.51Å
O2P	P	doub	1.48Å	1.62Å
O5	C5	sing	1.43Å	1.43Å
O5	P	sing	1.61Å	1.61Å
P	O1P	sing	1.61Å	1.61Å
P	O3P	sing	1.61Å	1.48Å
O1P	H1A	sing	0.97Å	0.95Å
O3P	H2A	sing	0.97Å	0.95Å
C5	H51	sing	1.09Å	1.10Å
C5	H52	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C2	H9	sing	1.09Å	1.10Å
C1	H1	sing	1.09Å	1.10Å
O1	HO1	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C3	C2	C1	103.4°	100.9°
C2	C3	C4	103.5°	102.3°
C2	C3	H3	110.9°	110.8°
C2	C3	H7	111.0°	111.0°
C3	C2	H2	111.0°	111.1°
C3	C2	H9	111.0°	111.2°
C2	C1	O1	108.9°	110.3°
C2	C1	O4	103.5°	105.1°
C1	C2	H2	111.0°	111.1°
C1	C2	H9	110.9°	111.1°
C2	C1	H1	111.3°	110.3°
C3	C4	O4	104.3°	107.6°
C3	C4	C5	107.8°	109.8°
C3	C4	H4	111.6°	109.9°
C4	C3	H3	110.9°	110.9°
C4	C3	H7	110.9°	110.9°
O1	C1	O4	106.9°	110.3°
O1	C1	H1	112.9°	110.2°
C1	O1	HO1	109.5°	114.0°
C1	O4	C4	103.2°	110.0°
O4	C1	H1	112.9°	110.4°
O4	C4	C5	108.0°	109.8°
O4	C4	H4	112.9°	109.8°
C4	C5	O5	111.2°	109.5°
C4	C5	H51	109.0°	109.5°
C4	C5	H52	109.0°	109.5°
C5	C4	H4	111.8°	109.9°
O2P	P	O5	106.3°	109.5°
O2P	P	O1P	105.1°	109.5°
O2P	P	O3P	112.8°	109.5°
C5	O5	P	119.0°	123.0°
O5	C5	H51	109.1°	109.5°
O5	C5	H52	109.0°	109.4°
O5	P	O1P	107.8°	109.4°
O5	P	O3P	112.9°	109.5°
O1P	P	O3P	111.5°	109.5°
P	O1P	H1A	109.5°	114.0°
P	O3P	H2A	109.5°	114.0°
H51	C5	H52	109.5°	109.5°
H3	C3	H7	109.5°	110.8°
H2	C2	H9	109.5°	111.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C3	C2	C1	H2	119.0°	117.9°
C3	C2	C1	H9	119.0°	117.9°
C2	C3	C4	H3	119.0°	118.2°
C2	C3	C4	H7	119.0°	118.4°
C3	C2	C1	O1	82.6°	155.4°
C3	C2	C1	O4	30.8°	36.5°
C2	C3	C4	O4	23.5°	21.4°
C2	C3	C4	C5	138.1°	140.9°
C2	C3	C4	H4	98.8°	98.1°
C2	C3	H3	H7	122.8°	123.6°
C3	C2	H2	H9	122.8°	124.3°
C3	C2	C1	H1	152.3°	82.5°
C1	C2	C3	C4	4.2°	34.2°
C2	C1	O1	O4	111.2°	115.7°
C2	C1	O1	H1	124.1°	122.1°
C2	C1	O4	H1	120.4°	119.0°
C2	C1	O4	C4	47.0°	24.4°
C1	C2	C3	H3	114.8°	84.1°
C1	C2	C3	H7	123.2°	152.4°
C1	C2	H2	H9	122.8°	124.2°
C2	C1	O1	HO1	180.0°	180.0°
C3	C4	O4	C1	44.3°	1.7°
C3	C4	O4	C5	114.5°	119.5°
C3	C4	O4	H4	121.3°	119.6°
C3	C4	C5	H4	123.0°	121.0°
C3	C4	C5	O5	71.0°	175.4°
C3	C4	C5	H51	49.2°	64.6°
C3	C4	C5	H52	168.7°	55.5°
C4	C3	H3	H7	122.8°	123.5°
C4	C3	C2	H2	114.8°	152.0°
C4	C3	C2	H9	123.2°	83.8°
O1	C1	O4	H1	124.8°	122.1°
O1	C1	O4	C4	67.9°	143.4°
O1	C1	C2	H2	158.3°	86.7°
O1	C1	C2	H9	36.4°	37.4°
C1	O4	C4	C5	158.8°	117.8°
C1	O4	C4	H4	77.1°	121.3°
O4	C1	C2	H2	88.2°	154.3°
O4	C1	C2	H9	149.8°	81.5°
O4	C1	O1	HO1	68.8°	64.3°
O4	C4	C5	H4	124.9°	120.9°
O4	C4	C5	O5	176.8°	66.5°
O4	C4	C5	H51	62.9°	53.5°
O4	C4	C5	H52	56.6°	173.6°
O4	C4	C3	H3	142.5°	96.8°
O4	C4	C3	H7	95.6°	139.7°
C4	O4	C1	H1	167.3°	94.5°
C4	C5	O5	H51	120.2°	120.0°
C4	C5	O5	H52	120.2°	120.0°
C4	C5	O5	P	176.5°	180.0°
C4	C5	H51	H52	119.2°	120.0°
C5	C4	C3	H3	102.9°	22.7°
C5	C4	C3	H7	19.1°	100.8°
O2P	P	O5	C5	134.6°	55.0°
O2P	P	O5	O1P	112.2°	120.0°
O2P	P	O5	O3P	124.2°	120.1°
O2P	P	O1P	O3P	122.6°	120.0°
O2P	P	O1P	H1A	0.0°	60.0°
O2P	P	O3P	H2A	0.0°	179.9°
C5	O5	P	O1P	22.3°	175.0°
C5	O5	P	O3P	101.2°	65.0°
O5	C5	H51	H52	119.2°	120.0°
O5	C5	C4	H4	52.0°	54.4°
O5	P	O1P	O3P	124.4°	120.0°
O5	P	O1P	H1A	113.0°	180.0°
O5	P	O3P	H2A	120.5°	59.9°
P	O5	C5	H51	63.3°	60.0°
P	O5	C5	H52	56.2°	60.0°
O1P	P	O3P	H2A	118.0°	60.1°
O3P	P	O1P	H1A	122.6°	60.0°
H51	C5	C4	H4	172.2°	174.4°
H52	C5	C4	H4	68.3°	65.6°
H4	C4	C3	H3	20.3°	143.7°
H4	C4	C3	H7	142.2°	20.2°
H3	C3	C2	H2	126.2°	33.8°
H3	C3	C2	H9	4.2°	158.0°
H7	C3	C2	H2	4.2°	89.7°
H7	C3	C2	H9	117.8°	34.5°
H2	C2	C1	H1	33.3°	35.3°
H9	C2	C1	H1	88.7°	159.5°
H1	C1	O1	HO1	55.9°	57.9°

Release date:	2013-07-31
Definition date:	2013-07-22
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB
Derived from:	4LR9