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Summary Geometry Related PDB entries

7CL

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	CL1	sing	1.80Å	1.80Å
C2	C1	sing	1.53Å	1.53Å
C1	H1	sing	1.09Å	1.10Å
C1	H1A	sing	1.09Å	1.10Å
C3	C2	sing	1.53Å	1.54Å
C2	H2	sing	1.09Å	1.10Å
C2	H2A	sing	1.09Å	1.10Å
C4	C3	sing	1.53Å	1.54Å
C3	H3	sing	1.09Å	1.10Å
C3	H3A	sing	1.09Å	1.10Å
C4	C5	sing	1.53Å	1.54Å
C4	H4	sing	1.09Å	1.10Å
C4	H4A	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
C5	H5A	sing	1.09Å	1.10Å
C5	H5B	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CL1	C1	C2	112.1°	109.5°
CL1	C1	H1	108.6°	109.5°
CL1	C1	H1A	108.0°	109.5°
C2	C1	H1	108.6°	109.5°
C2	C1	H1A	108.0°	109.5°
C1	C2	C3	107.5°	109.4°
C1	C2	H2	110.1°	109.5°
C1	C2	H2A	110.6°	109.5°
H1	C1	H1A	111.5°	109.5°
C3	C2	H2	110.1°	109.5°
C3	C2	H2A	110.6°	109.5°
C2	C3	C4	110.2°	109.4°
C2	C3	H3	109.2°	109.5°
C2	C3	H3A	109.1°	109.5°
H2	C2	H2A	107.9°	109.5°
C4	C3	H3	109.2°	109.5°
C4	C3	H3A	109.1°	109.4°
C3	C4	C5	110.4°	109.4°
C3	C4	H4	109.2°	109.5°
C3	C4	H4A	109.0°	109.5°
H3	C3	H3A	110.0°	109.5°
C5	C4	H4	109.2°	109.5°
C5	C4	H4A	109.0°	109.4°
C4	C5	H5	109.5°	109.4°
C4	C5	H5A	109.4°	109.5°
C4	C5	H5B	109.5°	109.5°
H4	C4	H4A	110.2°	109.5°
H5	C5	H5A	109.5°	109.4°
H5	C5	H5B	109.5°	109.5°
H5A	C5	H5B	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CL1	C1	C2	H1	120.0°	120.0°
CL1	C1	C2	H1A	118.9°	120.0°
CL1	C1	H1	H1A	118.9°	120.0°
CL1	C1	C2	C3	169.6°	180.0°
CL1	C1	C2	H2	49.7°	60.0°
CL1	C1	C2	H2A	69.6°	60.0°
C2	C1	H1	H1A	118.9°	120.0°
C1	C2	C3	H2	120.0°	120.0°
C1	C2	C3	H2A	120.8°	120.0°
C1	C2	H2	H2A	120.8°	120.0°
C1	C2	C3	C4	145.8°	180.0°
C1	C2	C3	H3	94.2°	60.0°
C1	C2	C3	H3A	26.1°	60.1°
H1	C1	C2	C3	70.4°	60.0°
H1	C1	C2	H2	169.7°	NaN°
H1	C1	C2	H2A	50.4°	60.0°
H1A	C1	C2	C3	50.7°	60.0°
H1A	C1	C2	H2	69.2°	60.0°
H1A	C1	C2	H2A	171.5°	180.0°
C3	C2	H2	H2A	120.8°	120.0°
C2	C3	C4	H3	120.0°	120.0°
C2	C3	C4	H3A	119.7°	120.0°
C2	C3	H3	H3A	119.7°	120.1°
C2	C3	C4	C5	159.1°	180.0°
C2	C3	C4	H4	39.1°	60.0°
C2	C3	C4	H4A	81.2°	60.1°
H2	C2	C3	C4	25.8°	60.0°
H2	C2	C3	H3	145.8°	179.9°
H2	C2	C3	H3A	93.9°	60.0°
H2A	C2	C3	C4	93.4°	60.0°
H2A	C2	C3	H3	26.6°	60.0°
H2A	C2	C3	H3A	146.9°	180.0°
C4	C3	H3	H3A	119.7°	119.9°
C3	C4	C5	H4	120.0°	120.0°
C3	C4	C5	H4A	119.7°	119.9°
C3	C4	H4	H4A	119.7°	120.0°
C3	C4	C5	H5	123.9°	180.0°
C3	C4	C5	H5A	3.9°	60.0°
C3	C4	C5	H5B	116.1°	60.0°
H3	C3	C4	C5	80.9°	60.0°
H3	C3	C4	H4	159.1°	180.0°
H3	C3	C4	H4A	38.8°	60.0°
H3A	C3	C4	C5	39.4°	60.0°
H3A	C3	C4	H4	80.6°	60.0°
H3A	C3	C4	H4A	159.1°	179.9°
C5	C4	H4	H4A	119.6°	120.0°
C4	C5	H5	H5A	120.0°	120.0°
C4	C5	H5	H5B	120.0°	120.0°
C4	C5	H5A	H5B	120.0°	120.1°
H4	C4	C5	H5	116.1°	60.0°
H4	C4	C5	H5A	123.9°	179.9°
H4	C4	C5	H5B	3.9°	60.0°
H4A	C4	C5	H5	4.3°	60.1°
H4A	C4	C5	H5A	115.7°	59.9°
H4A	C4	C5	H5B	124.3°	180.0°
H5	C5	H5A	H5B	120.0°	120.0°

227344

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