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Summary Geometry Related PDB entries

FW2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O2	C1	doub	1.21Å	1.26Å
O6	C6	sing	1.43Å	1.40Å
O1	C1	sing	1.35Å	1.26Å
O5	C5	sing	1.43Å	1.40Å
C1	C2	sing	1.49Å	1.53Å
C5	C6	sing	1.53Å	1.53Å
C5	C4	sing	1.53Å	1.52Å
C2	C3	sing	1.51Å	1.53Å
C4	C3	sing	1.53Å	1.52Å
C4	O4	sing	1.43Å	1.40Å
C3	H7	sing	1.09Å	1.10Å
C3	H8	sing	1.09Å	1.10Å
C4	H1	sing	1.09Å	1.10Å
C5	H	sing	1.09Å	1.10Å
C6	H4	sing	1.09Å	1.10Å
C6	H3	sing	1.09Å	1.10Å
O1	H11	sing	0.97Å	0.95Å
O4	H6	sing	0.97Å	0.95Å
O5	H5	sing	0.97Å	0.95Å
O6	H2	sing	0.97Å	0.95Å
C2	O3	doub	1.21Å	1.27Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O2	C1	O1	119.2°	120.0°
O2	C1	C2	120.9°	120.0°
O6	C6	C5	109.8°	109.5°
O6	C6	H4	109.4°	109.5°
O6	C6	H3	109.4°	109.4°
C6	O6	H2	109.5°	114.0°
O1	C1	C2	119.9°	120.0°
C1	O1	H11	109.5°	117.0°
O5	C5	C6	110.2°	109.5°
O5	C5	C4	108.7°	109.5°
O5	C5	H	109.9°	109.5°
C5	O5	H5	109.5°	114.0°
C1	C2	C3	119.0°	120.0°
C1	C2	O3	111.6°	120.0°
C6	C5	C4	111.6°	109.5°
C6	C5	H	108.2°	109.4°
C5	C6	H4	109.4°	109.5°
C5	C6	H3	109.4°	109.5°
C5	C4	C3	108.6°	109.4°
C5	C4	O4	111.3°	109.5°
C5	C4	H1	108.6°	109.4°
C4	C5	H	108.2°	109.5°
C2	C3	C4	109.9°	109.5°
C2	C3	H7	109.3°	109.5°
C2	C3	H8	109.4°	109.4°
C3	C2	O3	129.4°	120.0°
C3	C4	O4	109.3°	109.5°
C4	C3	H7	109.4°	109.5°
C4	C3	H8	109.3°	109.5°
C3	C4	H1	108.7°	109.5°
O4	C4	H1	110.4°	109.5°
C4	O4	H6	109.5°	113.9°
H7	C3	H8	109.5°	109.5°
H4	C6	H3	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O2	C1	O1	C2	179.8°	179.8°
O2	C1	C2	C3	166.3°	0.3°
O2	C1	O1	H11	0.0°	0.2°
O2	C1	C2	O3	11.4°	179.7°
O6	C6	C5	O5	53.4°	65.0°
O6	C6	C5	H4	120.0°	120.0°
O6	C6	C5	H3	120.1°	120.0°
O6	C6	C5	C4	174.2°	175.0°
O6	C6	C5	H	66.8°	55.0°
O6	C6	H4	H3	119.9°	120.0°
O1	C1	C2	C3	13.6°	180.0°
O1	C1	C2	O3	168.8°	0.0°
O5	C5	C6	C4	120.8°	120.0°
O5	C5	C6	H	120.2°	120.0°
O5	C5	C4	H	119.3°	120.1°
O5	C5	C4	C3	78.2°	60.0°
O5	C5	C4	O4	161.5°	180.0°
O5	C5	C4	H1	39.8°	60.0°
O5	C5	C6	H4	173.4°	55.0°
O5	C5	C6	H3	66.7°	175.0°
C1	C2	C3	O3	177.1°	180.0°
C1	C2	C3	C4	103.6°	180.0°
C1	C2	C3	H7	136.4°	60.0°
C1	C2	C3	H8	16.5°	60.0°
C2	C1	O1	H11	179.8°	180.0°
C6	C5	C4	H	119.0°	119.9°
C6	C5	C4	C3	160.1°	180.0°
C6	C5	C4	O4	39.8°	60.0°
C6	C5	C4	H1	81.9°	60.1°
C5	C6	H4	H3	119.9°	120.0°
C6	C5	O5	H5	180.0°	60.0°
C5	C6	O6	H2	180.0°	180.0°
C5	C4	C3	C2	67.0°	175.0°
C5	C4	C3	O4	121.5°	120.0°
C5	C4	C3	H1	118.0°	119.9°
C5	C4	O4	H1	120.7°	120.0°
C5	C4	C3	H7	172.9°	65.0°
C5	C4	C3	H8	53.1°	55.0°
C4	C5	C6	H4	65.7°	65.0°
C4	C5	C6	H3	54.2°	55.0°
C5	C4	O4	H6	180.0°	60.0°
C4	C5	O5	H5	57.4°	60.0°
C2	C3	C4	H7	120.0°	120.0°
C2	C3	C4	H8	120.1°	120.0°
C2	C3	C4	O4	171.5°	65.0°
C2	C3	H7	H8	119.8°	120.0°
C2	C3	C4	H1	50.9°	55.1°
C3	C4	O4	H1	119.4°	120.0°
C4	C3	H7	H8	119.8°	120.0°
C3	C4	C5	H	41.1°	60.1°
C3	C4	O4	H6	60.1°	60.0°
C4	C3	C2	O3	79.3°	0.0°
O4	C4	C3	H7	51.4°	55.0°
O4	C4	C3	H8	68.4°	175.0°
O4	C4	C5	H	79.2°	60.0°
H7	C3	C4	H1	69.1°	175.1°
H7	C3	C2	O3	40.8°	120.0°
H8	C3	C4	H1	171.0°	64.9°
H8	C3	C2	O3	160.7°	120.0°
H1	C4	C5	H	159.1°	180.0°
H1	C4	O4	H6	59.3°	180.0°
H	C5	C6	H4	53.2°	175.0°
H	C5	C6	H3	173.1°	65.0°
H	C5	O5	H5	60.8°	180.0°
H4	C6	O6	H2	60.0°	60.0°
H3	C6	O6	H2	59.9°	60.0°

218853

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