GBA

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N6	C6	sing	1.38Å	1.33Å
N1	C6	doub	1.33Å	1.34Å	Aromatic
N1	C2	sing	1.32Å	1.40Å	Aromatic
C6	C5	sing	1.41Å	1.34Å	Aromatic
C2	N3	doub	1.32Å	1.40Å	Aromatic
C5	N7	sing	1.36Å	1.33Å	Aromatic
C5	C4	doub	1.40Å	1.35Å	Aromatic
N7	C8	doub	1.30Å	1.32Å	Aromatic
N3	C4	sing	1.33Å	1.36Å	Aromatic
C4	N9	sing	1.37Å	1.33Å	Aromatic
C8	N9	sing	1.36Å	1.33Å	Aromatic
C8	BR8	sing	1.89Å	1.94Å
N9	C1'	sing	1.46Å	1.50Å
O5'	C5'	sing	1.43Å	1.45Å
O4'	C1'	sing	1.44Å	1.44Å
O4'	C4'	sing	1.44Å	1.45Å
C1'	C2'	sing	1.55Å	1.55Å
C5'	C4'	sing	1.53Å	1.54Å
C4'	C3'	sing	1.54Å	1.54Å
C2'	C3'	sing	1.55Å	1.51Å
C2'	O2'	sing	1.43Å	1.44Å
C3'	O3'	sing	1.43Å	1.44Å
O2'	H1	sing	0.97Å	0.95Å
C2'	H2	sing	1.09Å	1.10Å
C3'	H3	sing	1.09Å	1.10Å
O3'	H4	sing	0.97Å	0.95Å
C4'	H5	sing	1.09Å	1.10Å
C5'	H6	sing	1.09Å	1.10Å
C5'	H7	sing	1.09Å	1.10Å
O5'	H8	sing	0.97Å	0.95Å
C1'	H9	sing	1.09Å	1.10Å
C2	H10	sing	1.08Å	1.08Å
N6	H11	sing	0.97Å	1.00Å
N6	H12	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N6	C6	N1	120.5°	120.8°
N6	C6	C5	117.7°	120.8°
C6	N6	H11	109.5°	120.0°
C6	N6	H12	109.5°	120.0°
C6	N1	C2	120.5°	121.2°
N1	C6	C5	121.7°	118.5°
N1	C2	N3	116.8°	122.4°
N1	C2	H10	121.6°	118.8°
C6	C5	N7	132.0°	134.7°
C6	C5	C4	119.8°	118.2°
C2	N3	C4	120.1°	120.6°
N3	C2	H10	121.6°	118.8°
N7	C5	C4	108.2°	107.2°
C5	N7	C8	107.1°	109.4°
C5	C4	N3	121.1°	119.1°
C5	C4	N9	108.0°	106.0°
N7	C8	N9	109.9°	110.0°
N7	C8	BR8	124.4°	125.0°
N3	C4	N9	130.9°	134.9°
C4	N9	C8	106.8°	107.4°
C4	N9	C1'	123.7°	126.3°
N9	C8	BR8	125.7°	125.0°
C8	N9	C1'	129.4°	126.3°
N9	C1'	O4'	111.6°	110.6°
N9	C1'	C2'	113.4°	110.6°
N9	C1'	H9	108.8°	110.7°
O5'	C5'	C4'	109.9°	109.5°
O5'	C5'	H6	109.4°	109.5°
O5'	C5'	H7	109.4°	109.5°
C5'	O5'	H8	109.5°	113.9°
C1'	O4'	C4'	107.9°	107.0°
O4'	C1'	C2'	105.0°	103.5°
O4'	C1'	H9	109.6°	110.6°
O4'	C4'	C5'	107.7°	110.0°
O4'	C4'	C3'	107.9°	107.3°
O4'	C4'	H5	110.3°	109.9°
C1'	C2'	C3'	102.2°	102.1°
C1'	C2'	O2'	111.6°	110.9°
C1'	C2'	H2	109.7°	110.9°
C2'	C1'	H9	108.2°	110.6°
C5'	C4'	C3'	113.0°	109.9°
C5'	C4'	H5	109.0°	109.8°
C4'	C5'	H6	109.4°	109.4°
C4'	C5'	H7	109.4°	109.5°
C4'	C3'	C2'	104.2°	104.2°
C4'	C3'	O3'	109.0°	110.5°
C4'	C3'	H3	111.0°	110.6°
C3'	C4'	H5	109.0°	109.9°
C3'	C2'	O2'	111.4°	110.9°
C2'	C3'	O3'	108.2°	110.5°
C3'	C2'	H2	110.2°	110.9°
C2'	C3'	H3	111.5°	110.5°
C2'	O2'	H1	109.5°	114.0°
O2'	C2'	H2	111.3°	110.8°
O3'	C3'	H3	112.6°	110.4°
C3'	O3'	H4	109.5°	114.0°
H6	C5'	H7	109.5°	109.4°
H11	N6	H12	109.4°	119.9°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N6	C6	N1	C5	175.9°	179.9°
N6	C6	N1	C2	174.6°	179.9°
N6	C6	C5	N7	4.1°	0.1°
N6	C6	C5	C4	177.1°	179.9°
C6	N6	H11	H12	120.0°	179.9°
C6	N1	C2	N3	3.2°	0.2°
N1	C6	C5	N7	179.9°	180.0°
N1	C6	C5	C4	1.1°	0.0°
C6	N1	C2	H10	176.8°	179.9°
N1	C6	N6	H11	0.0°	180.0°
N1	C6	N6	H12	120.0°	0.1°
C2	N1	C6	C5	1.3°	0.0°
N1	C2	N3	H10	180.0°	179.8°
N1	C2	N3	C4	2.7°	0.5°
C6	C5	N7	C4	178.9°	180.0°
C6	C5	N7	C8	178.9°	180.0°
C6	C5	C4	N3	1.5°	0.3°
C6	C5	C4	N9	180.0°	180.0°
C5	C6	N6	H11	176.1°	0.1°
C5	C6	N6	H12	64.0°	180.0°
C2	N3	C4	C5	0.5°	0.5°
C2	N3	C4	N9	177.6°	179.8°
N7	C5	C4	N3	179.4°	179.8°
N7	C5	C4	N9	1.0°	0.0°
C5	N7	C8	N9	0.9°	0.0°
C5	N7	C8	BR8	177.8°	180.0°
C4	C5	N7	C8	0.0°	0.0°
C5	C4	N3	N9	178.0°	179.7°
C5	C4	N9	C8	1.6°	0.0°
C5	C4	N9	C1'	178.6°	180.0°
N7	C8	N9	C4	1.6°	0.1°
N7	C8	N9	BR8	178.8°	179.9°
N7	C8	N9	C1'	178.6°	180.0°
N3	C4	N9	C8	179.8°	179.7°
N3	C4	N9	C1'	0.4°	0.2°
C4	N3	C2	H10	177.3°	179.7°
C4	N9	C8	C1'	179.8°	179.9°
C4	N9	C8	BR8	177.2°	180.0°
C4	N9	C1'	O4'	118.2°	136.4°
C4	N9	C1'	C2'	123.4°	109.5°
C4	N9	C1'	H9	2.9°	13.5°
C8	N9	C1'	O4'	61.7°	43.5°
C8	N9	C1'	C2'	56.7°	70.6°
C8	N9	C1'	H9	177.2°	166.5°
BR8	C8	N9	C1'	2.6°	0.1°
N9	C1'	O4'	C2'	123.3°	118.5°
N9	C1'	O4'	H9	120.6°	123.0°
N9	C1'	O4'	C4'	152.8°	158.6°
N9	C1'	C2'	H9	120.9°	123.0°
N9	C1'	C2'	C3'	158.4°	155.5°
N9	C1'	C2'	O2'	82.5°	86.3°
N9	C1'	C2'	H2	41.4°	37.3°
O5'	C5'	C4'	O4'	51.8°	67.1°
O5'	C5'	C4'	H6	120.0°	120.0°
O5'	C5'	C4'	H7	120.1°	120.0°
O5'	C5'	C4'	C3'	170.9°	175.0°
O5'	C5'	C4'	H5	67.8°	54.0°
O5'	C5'	H6	H7	119.8°	120.0°
O4'	C1'	C2'	H9	117.0°	118.5°
C1'	O4'	C4'	C5'	133.3°	146.0°
C1'	O4'	C4'	C3'	11.0°	26.6°
O4'	C1'	C2'	C3'	36.3°	37.0°
O4'	C1'	C2'	O2'	155.4°	155.2°
O4'	C1'	C2'	H2	80.7°	81.2°
C1'	O4'	C4'	H5	107.9°	92.9°
C4'	O4'	C1'	C2'	29.5°	40.1°
O4'	C4'	C5'	C3'	119.1°	117.9°
O4'	C4'	C5'	H5	119.6°	121.1°
O4'	C4'	C3'	H5	119.7°	119.5°
O4'	C4'	C3'	C2'	12.3°	2.1°
O4'	C4'	C3'	O3'	103.0°	120.7°
O4'	C4'	C3'	H3	132.4°	116.7°
O4'	C4'	C5'	H6	68.2°	172.9°
O4'	C4'	C5'	H7	171.9°	52.9°
C4'	O4'	C1'	H9	86.6°	78.4°
C1'	C2'	C3'	C4'	28.7°	20.9°
C1'	C2'	C3'	O2'	119.3°	118.2°
C1'	C2'	C3'	H2	116.6°	118.2°
C1'	C2'	O2'	H2	123.0°	123.6°
C1'	C2'	C3'	O3'	87.2°	97.8°
C1'	C2'	O2'	H1	180.0°	174.2°
C1'	C2'	C3'	H3	148.4°	139.7°
C5'	C4'	C3'	H5	121.3°	121.0°
C5'	C4'	C3'	C2'	106.7°	121.6°
C5'	C4'	C3'	O3'	138.1°	119.7°
C5'	C4'	C3'	H3	13.5°	2.8°
C4'	C5'	H6	H7	119.8°	120.0°
C4'	C5'	O5'	H8	180.0°	180.0°
C4'	C3'	C2'	O3'	115.9°	118.7°
C4'	C3'	C2'	H3	119.8°	118.8°
C4'	C3'	C2'	O2'	148.0°	139.1°
C4'	C3'	O3'	H3	123.7°	122.6°
C4'	C3'	C2'	H2	88.0°	97.3°
C4'	C3'	O3'	H4	180.0°	65.2°
C3'	C4'	C5'	H6	50.8°	55.0°
C3'	C4'	C5'	H7	69.0°	64.9°
C3'	C2'	O2'	H2	123.5°	123.7°
C2'	C3'	O3'	H3	123.7°	122.6°
C3'	C2'	O2'	H1	66.5°	61.5°
C2'	C3'	O3'	H4	67.3°	180.0°
C2'	C3'	C4'	H5	132.0°	117.4°
C3'	C2'	C1'	H9	80.8°	81.4°
O2'	C2'	C3'	O3'	32.1°	20.4°
O2'	C2'	C3'	H3	92.3°	102.1°
O2'	C2'	C1'	H9	38.4°	36.8°
O3'	C3'	C2'	H2	156.2°	144.0°
O3'	C3'	C4'	H5	16.7°	1.3°
H1	O2'	C2'	H2	57.0°	62.2°
H2	C2'	C3'	H3	31.8°	21.5°
H2	C2'	C1'	H9	162.3°	160.3°
H3	C3'	O3'	H4	56.3°	57.4°
H3	C3'	C4'	H5	107.9°	123.8°
H5	C4'	C5'	H6	172.2°	66.0°
H5	C4'	C5'	H7	52.3°	174.0°
H6	C5'	O5'	H8	59.9°	60.0°
H7	C5'	O5'	H8	60.0°	60.0°

Release date:	2019-05-15
Definition date:	2018-05-18
Last modified:	2019-05-10
Release status:	REL
Processing site:	RCSB
Derived from:	6DFO