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Summary Geometry Related PDB entries

Obsolete: KGR

KGR was replaced with GLR on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1B	C1	doub	1.22Å	1.26Å
O1A	C1	sing	1.22Å	1.27Å
C1	C2	sing	1.51Å	1.48Å
C2	O2	sing	1.43Å	1.52Å
C2	C3	sing	1.53Å	1.53Å
C2	H21	sing	1.09Å	1.11Å
O2	HO21	sing	0.97Å	0.95Å
C3	O3	sing	1.43Å	1.42Å
C3	C4	sing	1.53Å	1.53Å
C3	H31	sing	1.09Å	1.11Å
O3	HO31	sing	0.97Å	0.95Å
C4	C5	sing	1.51Å	1.54Å
C4	H41	sing	1.09Å	1.12Å
C4	H42	sing	1.09Å	1.12Å
O5	C5	doub	1.21Å	1.23Å
C5	C6	sing	1.49Å	1.47Å
C6	O6A	doub	1.28Å	1.28Å
C6	O6B	sing	1.28Å	1.27Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1B	C1	O1A	123.2°	120.0°
O1B	C1	C2	119.2°	120.0°
O1A	C1	C2	117.7°	120.0°
C1	C2	O2	113.5°	109.5°
C1	C2	C3	109.7°	109.5°
C1	C2	H21	107.4°	109.5°
O2	C2	C3	111.9°	109.5°
O2	C2	H21	104.9°	109.5°
C2	O2	HO21	113.5°	106.8°
C3	C2	H21	109.1°	109.4°
C2	C3	O3	112.4°	109.4°
C2	C3	C4	112.4°	109.5°
C2	C3	H31	105.7°	109.5°
O3	C3	C4	110.5°	109.5°
O3	C3	H31	107.8°	109.5°
C3	O3	HO31	112.4°	106.8°
C4	C3	H31	107.8°	109.5°
C3	C4	C5	115.5°	109.5°
C3	C4	H41	110.0°	109.5°
C3	C4	H42	110.0°	109.5°
C5	C4	H41	110.0°	109.5°
C5	C4	H42	110.0°	109.5°
C4	C5	O5	123.3°	120.0°
C4	C5	C6	115.7°	120.0°
H41	C4	H42	100.2°	109.4°
O5	C5	C6	121.0°	120.0°
C5	C6	O6A	118.7°	120.0°
C5	C6	O6B	118.7°	120.0°
O6A	C6	O6B	122.6°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1B	C1	O1A	C2	179.5°	180.0°
O1B	C1	C2	O2	10.5°	175.0°
O1B	C1	C2	C3	115.5°	65.0°
O1B	C1	C2	H21	126.0°	55.0°
O1A	C1	C2	O2	169.9°	5.0°
O1A	C1	C2	C3	64.1°	115.0°
O1A	C1	C2	H21	54.4°	125.0°
C1	C2	O2	C3	124.8°	120.0°
C1	C2	O2	H21	117.0°	120.0°
C1	C2	C3	H21	117.4°	120.0°
C1	C2	O2	HO21	180.0°	60.0°
C1	C2	C3	O3	72.5°	55.0°
C1	C2	C3	C4	162.1°	175.0°
C1	C2	C3	H31	44.8°	65.0°
O2	C2	C3	H21	115.7°	120.0°
O2	C2	C3	O3	54.4°	65.0°
O2	C2	C3	C4	71.0°	55.0°
O2	C2	C3	H31	171.7°	175.0°
C3	C2	O2	HO21	55.2°	60.0°
C2	C3	O3	C4	126.4°	120.0°
C2	C3	O3	H31	116.1°	120.0°
C2	C3	C4	H31	116.0°	120.0°
C2	C3	O3	HO31	180.0°	60.0°
C2	C3	C4	C5	44.7°	175.0°
C2	C3	C4	H41	169.9°	64.9°
C2	C3	C4	H42	80.6°	55.0°
H21	C2	O2	HO21	63.1°	179.9°
H21	C2	C3	O3	170.0°	175.0°
H21	C2	C3	C4	44.7°	65.0°
H21	C2	C3	H31	72.6°	55.0°
O3	C3	C4	H31	117.5°	120.0°
O3	C3	C4	C5	171.1°	65.1°
O3	C3	C4	H41	63.6°	55.0°
O3	C3	C4	H42	45.8°	175.0°
C4	C3	O3	HO31	53.6°	59.9°
C3	C4	C5	H41	125.3°	120.0°
C3	C4	C5	H42	125.3°	120.0°
C3	C4	H41	H42	115.9°	120.0°
C3	C4	C5	O5	38.6°	0.1°
C3	C4	C5	C6	141.9°	180.0°
H31	C3	O3	HO31	64.0°	180.0°
H31	C3	C4	C5	71.4°	55.0°
H31	C3	C4	H41	53.9°	175.0°
H31	C3	C4	H42	163.4°	65.0°
C5	C4	H41	H42	115.8°	120.0°
C4	C5	O5	C6	179.4°	179.9°
C4	C5	C6	O6A	13.8°	180.0°
C4	C5	C6	O6B	166.0°	0.1°
H41	C4	C5	O5	86.7°	120.0°
H41	C4	C5	C6	92.8°	59.9°
H42	C4	C5	O5	163.9°	120.0°
H42	C4	C5	C6	16.6°	60.0°
O5	C5	C6	O6A	166.7°	0.1°
O5	C5	C6	O6B	13.4°	180.0°
C5	C6	O6A	O6B	179.9°	179.9°

227111

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