5AR

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C6	N18	sing	1.47Å	144.21Å
O01	C02	doub	1.21Å	1.19Å
C02	C27	sing	1.51Å	1.52Å
C28	C27	sing	1.53Å	1.53Å
C28	C29	sing	1.53Å	1.55Å
C27	N35	sing	1.47Å	1.44Å
N18	H22	sing	1.01Å	1.00Å
C6	H23	sing	1.09Å	143.19Å
C6	H24	sing	1.09Å	144.27Å
C27	H29	sing	1.09Å	1.10Å
C28	H30	sing	1.09Å	1.10Å
C28	H31	sing	1.09Å	1.10Å
C29	H32	sing	1.09Å	1.10Å
C29	H33	sing	1.09Å	1.10Å
N35	H35	sing	1.01Å	1.00Å
C29	C5	sing	1.51Å	151.20Å
C5	N1	doub	1.30Å	0.00Å	Aromatic
N1	N2	sing	1.29Å	0.00Å	Aromatic
N2	C4	doub	1.30Å	0.00Å	Aromatic
C4	O1	sing	1.34Å	0.00Å	Aromatic
O1	C5	sing	1.34Å	0.00Å	Aromatic
C4	C1	sing	1.51Å	0.00Å
C1	C2	sing	1.53Å	0.00Å
C2	C3	sing	1.53Å	0.00Å
C3	C6	sing	1.53Å	0.00Å
C1	H34	sing	1.09Å	0.00Å
C1	H45	sing	1.09Å	0.00Å
C2	H46	sing	1.09Å	0.00Å
C2	H47	sing	1.09Å	0.00Å
C3	H48	sing	1.09Å	0.00Å
C3	H49	sing	1.09Å	0.00Å
N18	H2	sing	1.01Å	1.00Å
C02	OXT	sing	1.34Å	1.46Å
OXT	HXT	sing	0.97Å	0.95Å
N35	H1	sing	1.01Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C6	N18	H22	109.5°	111.0°
N18	C6	H23	0.7°	109.5°
N18	C6	H24	0.8°	109.4°
N18	C6	C3	90.0°	109.5°
C6	N18	H2	109.5°	111.0°
O01	C02	C27	122.7°	120.0°
O01	C02	OXT	121.2°	120.0°
C02	C27	C28	108.9°	109.5°
C02	C27	N35	109.7°	109.4°
C02	C27	H29	109.3°	109.5°
C27	C02	OXT	116.1°	119.9°
C27	C28	C29	110.0°	109.5°
C28	C27	N35	109.1°	109.5°
C28	C27	H29	109.2°	109.5°
C27	C28	H30	109.3°	109.4°
C27	C28	H31	109.3°	109.4°
C29	C28	H30	109.3°	109.5°
C29	C28	H31	109.3°	109.5°
C28	C29	H32	123.0°	109.5°
C28	C29	H33	122.9°	109.5°
C28	C29	C5	39.2°	109.5°
N35	C27	H29	110.5°	109.4°
C27	N35	H35	109.5°	111.0°
C27	N35	H1	109.5°	110.9°
H22	N18	H2	109.5°	111.0°
H23	C6	H24	0.6°	109.5°
H23	C6	C3	90.0°	109.5°
H24	C6	C3	90.0°	109.5°
H30	C28	H31	109.5°	109.4°
H32	C29	H33	109.5°	109.5°
H32	C29	C5	122.9°	109.5°
H33	C29	C5	122.9°	109.4°
H35	N35	H1	109.5°	111.0°
C29	C5	N1	90.0°	126.3°
C29	C5	O1	90.0°	126.3°
C5	N1	N2	90.0°	109.4°
N1	C5	O1	90.0°	107.4°
N1	N2	C4	90.0°	109.4°
N2	C4	O1	90.0°	107.4°
N2	C4	C1	90.0°	126.3°
C4	O1	C5	90.0°	106.4°
O1	C4	C1	90.0°	126.3°
C4	C1	C2	90.0°	109.5°
C4	C1	H34	90.0°	109.4°
C4	C1	H45	90.0°	109.4°
C1	C2	C3	90.0°	109.5°
C2	C1	H34	90.0°	109.5°
C2	C1	H45	90.0°	109.5°
C1	C2	H46	90.0°	109.5°
C1	C2	H47	90.0°	109.5°
C2	C3	C6	90.0°	109.5°
C3	C2	H46	90.0°	109.5°
C3	C2	H47	90.0°	109.5°
C2	C3	H48	90.0°	109.5°
C2	C3	H49	90.0°	109.5°
C6	C3	H48	90.0°	109.5°
C6	C3	H49	90.0°	109.5°
H34	C1	H45	90.0°	109.5°
H46	C2	H47	90.0°	109.5°
H48	C3	H49	90.0°	109.5°
C02	OXT	HXT	109.5°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C6	N18	H22	H2	120.0°	124.0°
N18	C6	H23	H24	80.0°	120.0°
N18	C6	H23	C3	90.0°	120.0°
N18	C6	H24	C3	90.0°	120.0°
N18	C6	C3	C2	90.0°	180.0°
N18	C6	C3	H48	90.0°	60.0°
N18	C6	C3	H49	90.0°	60.0°
O01	C02	C27	OXT	179.8°	179.7°
O01	C02	C27	C28	95.0°	100.0°
O01	C02	C27	N35	24.3°	20.0°
O01	C02	C27	H29	145.6°	140.0°
O01	C02	OXT	HXT	0.0°	0.0°
C02	C27	C28	N35	119.8°	119.9°
C02	C27	C28	H29	119.4°	120.1°
C02	C27	C28	C29	162.6°	175.0°
C02	C27	N35	H29	120.6°	119.9°
C02	C27	C28	H30	77.4°	64.9°
C02	C27	C28	H31	42.5°	55.0°
C02	C27	N35	H35	180.0°	60.0°
C27	C02	OXT	HXT	179.8°	179.7°
C02	C27	N35	H1	60.0°	176.1°
C27	C28	C29	H30	120.1°	120.0°
C27	C28	C29	H31	120.1°	120.0°
C28	C27	N35	H29	120.1°	120.0°
C27	C28	H30	H31	119.8°	119.9°
C27	C28	C29	H32	93.2°	60.0°
C27	C28	C29	H33	60.1°	60.0°
C28	C27	N35	H35	60.7°	60.0°
C27	C28	C29	C5	163.4°	180.0°
C28	C27	C02	OXT	85.2°	79.7°
C28	C27	N35	H1	179.2°	63.9°
C29	C28	C27	N35	77.7°	65.0°
C29	C28	C27	H29	43.2°	55.0°
C29	C28	H30	H31	119.8°	120.0°
C28	C29	H32	H33	156.4°	120.0°
C28	C29	H32	C5	47.2°	120.0°
C28	C29	H33	C5	47.2°	120.0°
C28	C29	C5	N1	90.0°	90.0°
C28	C29	C5	O1	90.0°	90.0°
N35	C27	C28	H30	42.4°	55.0°
N35	C27	C28	H31	162.3°	174.9°
C27	N35	H35	H1	120.0°	123.9°
N35	C27	C02	OXT	155.4°	160.3°
H22	N18	C6	H23	167.0°	59.9°
H22	N18	C6	H24	126.1°	60.0°
H22	N18	C6	C3	90.0°	180.0°
H23	C6	H24	C3	90.0°	120.1°
H23	C6	C3	C2	90.0°	60.0°
H23	C6	C3	H48	90.0°	60.0°
H23	C6	C3	H49	90.0°	180.0°
H23	C6	N18	H2	73.0°	176.1°
H24	C6	C3	C2	90.0°	60.0°
H24	C6	C3	H48	90.0°	180.0°
H24	C6	C3	H49	90.0°	60.0°
H24	C6	N18	H2	113.9°	64.0°
H29	C27	C28	H30	163.3°	175.0°
H29	C27	C28	H31	76.9°	65.1°
H29	C27	N35	H35	59.4°	180.0°
H29	C27	C02	OXT	34.2°	40.4°
H29	C27	N35	H1	60.6°	56.1°
H30	C28	C29	H32	146.7°	180.0°
H30	C28	C29	H33	60.0°	60.0°
H30	C28	C29	C5	43.4°	60.0°
H31	C28	C29	H32	26.9°	60.0°
H31	C28	C29	H33	179.8°	180.0°
H31	C28	C29	C5	76.5°	60.0°
H32	C29	H33	C5	156.4°	120.0°
H32	C29	C5	N1	90.0°	30.0°
H32	C29	C5	O1	90.0°	150.0°
H33	C29	C5	N1	90.0°	150.0°
H33	C29	C5	O1	90.0°	30.0°
C29	C5	N1	O1	90.0°	180.0°
C29	C5	N1	N2	90.0°	180.0°
C29	C5	O1	C4	90.0°	180.0°
C5	N1	N2	C4	90.0°	0.0°
N1	C5	O1	C4	90.0°	0.0°
N1	N2	C4	O1	90.0°	0.0°
N2	N1	C5	O1	90.0°	0.0°
N1	N2	C4	C1	90.0°	180.0°
N2	C4	O1	C1	90.0°	179.9°
N2	C4	O1	C5	90.0°	0.0°
N2	C4	C1	C2	90.0°	90.0°
N2	C4	C1	H34	90.0°	150.0°
N2	C4	C1	H45	90.0°	30.0°
O1	C4	C1	C2	90.0°	89.9°
O1	C4	C1	H34	90.0°	30.1°
O1	C4	C1	H45	90.0°	150.0°
C5	O1	C4	C1	90.0°	180.0°
C4	C1	C2	H34	90.0°	120.0°
C4	C1	C2	H45	90.0°	120.0°
C4	C1	C2	C3	90.0°	180.0°
C4	C1	H34	H45	90.0°	119.9°
C4	C1	C2	H46	90.0°	60.0°
C4	C1	C2	H47	90.0°	60.0°
C1	C2	C3	H46	90.0°	120.0°
C1	C2	C3	H47	90.0°	120.0°
C1	C2	C3	C6	90.0°	180.0°
C2	C1	H34	H45	90.0°	120.1°
C1	C2	H46	H47	90.0°	120.0°
C1	C2	C3	H48	90.0°	60.0°
C1	C2	C3	H49	90.0°	60.0°
C2	C3	C6	H48	90.0°	120.0°
C2	C3	C6	H49	90.0°	120.0°
C3	C2	C1	H34	90.0°	60.0°
C3	C2	C1	H45	90.0°	60.0°
C3	C2	H46	H47	90.0°	120.0°
C2	C3	H48	H49	90.0°	120.0°
C6	C3	C2	H46	90.0°	60.0°
C6	C3	C2	H47	90.0°	60.0°
C6	C3	H48	H49	90.0°	120.0°
C3	C6	N18	H2	90.0°	56.0°
H34	C1	C2	H46	90.0°	NaN°
H34	C1	C2	H47	90.0°	60.0°
H45	C1	C2	H46	90.0°	60.0°
H45	C1	C2	H47	90.0°	180.0°
H46	C2	C3	H48	90.0°	180.0°
H46	C2	C3	H49	90.0°	60.0°
H47	C2	C3	H48	90.0°	60.0°
H47	C2	C3	H49	90.0°	180.0°

Release date:	2016-02-10
Definition date:	2015-08-31
Last modified:	2020-06-27
Release status:	REL
Processing site:	RCSB
Derived from:	5DGJ