M6T

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1'	C2'	doub	1.32Å	1.34Å	Aromatic
N1'	C6'	sing	1.33Å	1.35Å	Aromatic
C2'	CM2	sing	1.51Å	1.47Å
C2'	N3'	sing	1.32Å	1.31Å	Aromatic
CM2	HM21	sing	1.09Å	1.12Å
CM2	HM22	sing	1.09Å	1.12Å
CM2	HM23	sing	1.09Å	1.11Å
N3'	C4'	doub	1.33Å	1.36Å	Aromatic
C4'	N4'	sing	1.38Å	1.30Å
C4'	C5'	sing	1.40Å	1.42Å	Aromatic
N4'	HN41	sing	0.97Å	1.02Å
N4'	HN42	sing	0.97Å	1.02Å
C5'	C6'	doub	1.38Å	1.36Å	Aromatic
C5'	C7'	sing	1.51Å	1.52Å
C6'	CM6	sing	1.51Å	1.48Å
C7'	N3	sing	1.47Å	1.50Å
C7'	H7'1	sing	1.09Å	1.12Å
C7'	H7'2	sing	1.09Å	1.11Å
N3	C2	doub	1.31Å	1.34Å	Aromatic
N3	C4	sing	1.32Å	1.33Å	Aromatic
C2	S1	sing	1.74Å	1.70Å	Aromatic
C2	H2	sing	1.08Å	1.10Å
S1	C5	sing	1.79Å	1.72Å	Aromatic
C5	C4	doub	1.36Å	1.36Å	Aromatic
C5	C6	sing	1.51Å	1.50Å
C4	CM4	sing	1.51Å	1.48Å
CM4	HM41	sing	1.09Å	1.12Å
CM4	HM42	sing	1.09Å	1.11Å
CM4	HM43	sing	1.09Å	1.12Å
CM6	HM61	sing	1.09Å	1.11Å
CM6	HM62	sing	1.09Å	1.11Å
CM6	HM63	sing	1.09Å	1.12Å
C6	C7	sing	1.53Å	1.51Å
C6	H61	sing	1.09Å	1.11Å
C6	H62	sing	1.09Å	1.12Å
C7	O7	sing	1.43Å	1.43Å
C7	H71	sing	1.09Å	1.12Å
C7	H72	sing	1.09Å	1.11Å
O7	PA	sing	1.61Å	1.55Å
PA	O1A	doub	1.61Å	1.48Å
PA	O2A	sing	1.48Å	1.50Å
PA	O3A	sing	1.61Å	1.60Å
O2A	HOA2	sing	4.03Å	0.95Å
O3A	PB	sing	1.61Å	1.58Å
PB	O1B	doub	1.61Å	1.50Å
PB	O2B	sing	1.54Å	1.46Å
PB	O3B	sing	1.55Å	1.46Å
O2B	HOB2	sing	6.85Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2'	N1'	C6'	120.5°	121.0°
N1'	C2'	CM2	117.3°	119.1°
N1'	C2'	N3'	121.6°	121.8°
N1'	C6'	C5'	121.0°	119.2°
N1'	C6'	CM6	117.0°	120.4°
CM2	C2'	N3'	120.6°	119.1°
C2'	CM2	HM21	117.2°	109.5°
C2'	CM2	HM22	109.4°	109.5°
C2'	CM2	HM23	109.4°	109.4°
C2'	N3'	C4'	118.5°	120.7°
HM21	CM2	HM22	109.3°	109.5°
HM21	CM2	HM23	109.4°	109.5°
HM22	CM2	HM23	100.8°	109.4°
N3'	C4'	N4'	116.1°	120.6°
N3'	C4'	C5'	121.4°	118.9°
N4'	C4'	C5'	122.2°	120.5°
C4'	N4'	HN41	116.2°	120.1°
C4'	N4'	HN42	109.8°	120.0°
C4'	C5'	C6'	115.7°	118.3°
C4'	C5'	C7'	122.2°	120.8°
HN41	N4'	HN42	109.8°	119.9°
C6'	C5'	C7'	121.6°	120.9°
C5'	C6'	CM6	121.7°	120.4°
C5'	C7'	N3	109.5°	109.5°
C5'	C7'	H7'1	112.2°	109.5°
C5'	C7'	H7'2	112.2°	109.5°
C6'	CM6	HM61	117.0°	109.5°
C6'	CM6	HM62	109.5°	109.5°
C6'	CM6	HM63	109.5°	109.4°
N3	C7'	H7'1	112.1°	109.4°
N3	C7'	H7'2	112.1°	109.4°
C7'	N3	C2	123.1°	119.3°
C7'	N3	C4	123.3°	119.2°
H7'1	C7'	H7'2	98.3°	109.5°
C2	N3	C4	113.2°	121.5°
N3	C2	S1	112.3°	102.1°
N3	C2	H2	114.0°	128.9°
N3	C4	C5	111.4°	118.4°
N3	C4	CM4	122.1°	120.8°
S1	C2	H2	133.7°	128.9°
C2	S1	C5	88.7°	97.4°
S1	C5	C4	110.3°	100.6°
S1	C5	C6	121.1°	129.7°
C4	C5	C6	127.4°	129.7°
C5	C4	CM4	126.0°	120.8°
C5	C6	C7	113.2°	109.5°
C5	C6	H61	110.9°	109.5°
C5	C6	H62	110.9°	109.5°
C4	CM4	HM41	122.0°	109.5°
C4	CM4	HM42	107.7°	109.5°
C4	CM4	HM43	107.7°	109.4°
HM41	CM4	HM42	107.8°	109.5°
HM41	CM4	HM43	107.7°	109.4°
HM42	CM4	HM43	102.2°	109.4°
HM61	CM6	HM62	109.6°	109.5°
HM61	CM6	HM63	109.5°	109.5°
HM62	CM6	HM63	100.7°	109.5°
C7	C6	H61	110.8°	109.4°
C7	C6	H62	110.8°	109.4°
C6	C7	O7	109.1°	109.4°
C6	C7	H71	112.3°	109.5°
C6	C7	H72	112.4°	109.5°
H61	C6	H62	99.5°	109.5°
O7	C7	H71	112.3°	109.4°
O7	C7	H72	112.3°	109.5°
C7	O7	PA	117.4°	106.8°
H71	C7	H72	98.1°	109.5°
O7	PA	O1A	114.7°	109.5°
O7	PA	O2A	105.0°	109.5°
O7	PA	O3A	110.1°	109.5°
O1A	PA	O2A	113.3°	109.4°
O1A	PA	O3A	108.1°	109.4°
O2A	PA	O3A	105.3°	109.5°
PA	O2A	HOA2	105.0°	80.7°
PA	O3A	PB	134.2°	106.8°
O3A	PB	O1B	101.4°	109.4°
O3A	PB	O2B	100.3°	109.5°
O3A	PB	O3B	109.3°	109.5°
O1B	PB	O2B	112.8°	109.5°
O1B	PB	O3B	116.1°	109.5°
O2B	PB	O3B	114.8°	109.5°
PB	O2B	HOB2	100.3°	71.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1'	C2'	CM2	N3'	171.4°	179.7°
N1'	C2'	CM2	HM21	180.0°	90.0°
N1'	C2'	CM2	HM22	54.8°	150.0°
N1'	C2'	CM2	HM23	54.7°	30.0°
N1'	C2'	N3'	C4'	14.0°	0.6°
C2'	N1'	C6'	C5'	1.7°	0.0°
C2'	N1'	C6'	CM6	171.9°	180.0°
C6'	N1'	C2'	CM2	179.9°	180.0°
C6'	N1'	C2'	N3'	8.7°	0.3°
N1'	C6'	C5'	C4'	5.6°	0.0°
N1'	C6'	C5'	CM6	173.3°	180.0°
N1'	C6'	C5'	C7'	177.8°	180.0°
N1'	C6'	CM6	HM61	180.0°	90.0°
N1'	C6'	CM6	HM62	54.7°	150.0°
N1'	C6'	CM6	HM63	54.8°	30.0°
C2'	CM2	HM21	HM22	125.2°	120.0°
C2'	CM2	HM21	HM23	125.3°	120.0°
C2'	CM2	HM22	HM23	115.2°	119.9°
CM2	C2'	N3'	C4'	175.0°	179.7°
N3'	C2'	CM2	HM21	8.7°	90.3°
N3'	C2'	CM2	HM22	133.8°	29.8°
N3'	C2'	CM2	HM23	116.6°	149.7°
C2'	N3'	C4'	N4'	176.9°	179.7°
C2'	N3'	C4'	C5'	9.5°	0.6°
HM21	CM2	HM22	HM23	115.2°	120.0°
N3'	C4'	N4'	C5'	173.5°	179.7°
N3'	C4'	N4'	HN41	180.0°	175.4°
N3'	C4'	N4'	HN42	54.7°	4.7°
N3'	C4'	C5'	C6'	0.1°	0.3°
N3'	C4'	C5'	C7'	172.2°	179.7°
C4'	N4'	HN41	HN42	125.3°	180.0°
N4'	C4'	C5'	C6'	173.0°	180.0°
N4'	C4'	C5'	C7'	1.0°	0.0°
C5'	C4'	N4'	HN41	6.5°	4.9°
C5'	C4'	N4'	HN42	118.8°	175.0°
C4'	C5'	C6'	C7'	172.1°	180.0°
C4'	C5'	C6'	CM6	167.7°	180.0°
C4'	C5'	C7'	N3	71.4°	94.6°
C4'	C5'	C7'	H7'1	53.8°	25.3°
C4'	C5'	C7'	H7'2	163.4°	145.4°
C6'	C5'	C7'	N3	117.0°	85.3°
C6'	C5'	C7'	H7'1	117.8°	154.7°
C6'	C5'	C7'	H7'2	8.2°	34.6°
C5'	C6'	CM6	HM61	6.5°	90.0°
C5'	C6'	CM6	HM62	118.9°	30.0°
C5'	C6'	CM6	HM63	131.7°	150.0°
C7'	C5'	C6'	CM6	4.4°	0.0°
C5'	C7'	N3	H7'1	125.2°	120.0°
C5'	C7'	N3	H7'2	125.3°	120.0°
C5'	C7'	H7'1	H7'2	118.2°	120.1°
C5'	C7'	N3	C2	105.0°	5.5°
C5'	C7'	N3	C4	82.1°	174.8°
C6'	CM6	HM61	HM62	125.3°	120.0°
C6'	CM6	HM61	HM63	125.2°	119.9°
C6'	CM6	HM62	HM63	115.2°	119.9°
N3	C7'	H7'1	H7'2	118.1°	119.9°
C7'	N3	C2	C4	173.6°	179.7°
C7'	N3	C2	S1	179.4°	180.0°
C7'	N3	C2	H2	0.6°	0.0°
C7'	N3	C4	C5	168.1°	179.8°
C7'	N3	C4	CM4	4.0°	0.2°
H7'1	C7'	N3	C2	20.3°	114.5°
H7'1	C7'	N3	C4	152.7°	65.2°
H7'2	C7'	N3	C2	129.8°	125.5°
H7'2	C7'	N3	C4	43.2°	54.8°
N3	C2	S1	H2	179.9°	180.0°
N3	C2	S1	C5	5.8°	0.0°
C2	N3	C4	C5	18.3°	0.5°
C2	N3	C4	CM4	169.6°	179.9°
C4	N3	C2	S1	5.9°	0.3°
C4	N3	C2	H2	174.2°	179.7°
N3	C4	C5	S1	22.3°	0.4°
N3	C4	C5	CM4	171.7°	179.6°
N3	C4	C5	C6	170.7°	179.8°
N3	C4	CM4	HM41	180.0°	85.0°
N3	C4	CM4	HM42	54.7°	35.0°
N3	C4	CM4	HM43	54.8°	155.0°
C2	S1	C5	C4	15.8°	0.2°
C2	S1	C5	C6	176.3°	180.0°
H2	C2	S1	C5	174.1°	180.0°
S1	C5	C4	C6	167.0°	179.8°
S1	C5	C4	CM4	165.9°	180.0°
S1	C5	C6	C7	4.9°	90.0°
S1	C5	C6	H61	120.4°	29.9°
S1	C5	C6	H62	130.1°	150.0°
C5	C4	CM4	HM41	9.1°	95.4°
C5	C4	CM4	HM42	134.4°	144.5°
C5	C4	CM4	HM43	116.1°	24.6°
C4	C5	C6	C7	170.6°	90.3°
C4	C5	C6	H61	45.4°	149.8°
C4	C5	C6	H62	64.2°	29.7°
C6	C5	C4	CM4	1.0°	0.2°
C5	C6	C7	H61	125.3°	120.0°
C5	C6	C7	H62	125.3°	120.0°
C5	C6	H61	H62	116.7°	120.1°
C5	C6	C7	O7	169.0°	180.0°
C5	C6	C7	H71	43.7°	60.0°
C5	C6	C7	H72	65.7°	60.0°
C4	CM4	HM41	HM42	125.3°	120.1°
C4	CM4	HM41	HM43	125.2°	120.0°
C4	CM4	HM42	HM43	113.3°	119.9°
HM41	CM4	HM42	HM43	113.3°	120.0°
HM61	CM6	HM62	HM63	115.3°	120.1°
C7	C6	H61	H62	116.7°	120.0°
C6	C7	O7	H71	125.2°	120.0°
C6	C7	O7	H72	125.3°	120.0°
C6	C7	H71	H72	118.3°	120.1°
C6	C7	O7	PA	141.1°	180.0°
H61	C6	C7	O7	65.7°	60.0°
H61	C6	C7	H71	169.1°	180.0°
H61	C6	C7	H72	59.6°	60.0°
H62	C6	C7	O7	43.7°	60.0°
H62	C6	C7	H71	81.5°	60.0°
H62	C6	C7	H72	169.0°	180.0°
O7	C7	H71	H72	118.2°	120.0°
C7	O7	PA	O1A	72.9°	65.0°
C7	O7	PA	O2A	162.1°	55.0°
C7	O7	PA	O3A	49.2°	175.0°
H71	C7	O7	PA	15.9°	60.0°
H72	C7	O7	PA	93.5°	60.0°
O7	PA	O1A	O2A	120.5°	120.0°
O7	PA	O1A	O3A	123.2°	120.0°
O7	PA	O2A	O3A	116.2°	120.0°
O7	PA	O2A	HOA2	180.0°	44.8°
O7	PA	O3A	PB	92.2°	160.0°
O1A	PA	O2A	O3A	117.9°	120.0°
O1A	PA	O2A	HOA2	54.1°	75.2°
O1A	PA	O3A	PB	141.8°	80.0°
O2A	PA	O3A	PB	20.5°	40.0°
O3A	PA	O2A	HOA2	63.7°	164.8°
PA	O3A	PB	O1B	44.6°	165.0°
PA	O3A	PB	O2B	71.5°	75.0°
PA	O3A	PB	O3B	167.6°	45.0°
O3A	PB	O1B	O2B	106.4°	120.0°
O3A	PB	O1B	O3B	118.2°	120.0°
O3A	PB	O2B	O3B	116.9°	120.0°
O3A	PB	O2B	HOB2	180.0°	49.2°
O1B	PB	O2B	O3B	135.9°	120.0°
O1B	PB	O2B	HOB2	72.9°	169.2°
O3B	PB	O2B	HOB2	63.1°	70.7°

Definition date:	1999-07-08
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1TKC