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Summary Geometry Related PDB entries

CAC

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
AS	O1	doub	1.71Å	1.82Å
AS	O2	sing	1.71Å	1.78Å
AS	C1	sing	1.99Å	1.99Å
AS	C2	sing	1.99Å	1.97Å
C1	H11	sing	1.09Å	1.10Å
C1	H12	sing	1.09Å	1.10Å
C1	H13	sing	1.09Å	1.10Å
C2	H21	sing	1.09Å	1.10Å
C2	H22	sing	1.09Å	1.10Å
C2	H23	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	AS	O2	118.3°	109.5°
O1	AS	C1	101.4°	109.5°
O1	AS	C2	108.0°	109.5°
O2	AS	C1	113.5°	109.5°
O2	AS	C2	112.6°	109.5°
C1	AS	C2	101.2°	109.5°
AS	C1	H11	109.5°	109.5°
AS	C1	H12	109.5°	109.5°
AS	C1	H13	109.4°	109.5°
AS	C2	H21	109.5°	109.5°
AS	C2	H22	109.5°	109.5°
AS	C2	H23	109.5°	109.5°
H11	C1	H12	109.4°	109.4°
H11	C1	H13	109.5°	109.5°
H12	C1	H13	109.5°	109.5°
H21	C2	H22	109.4°	109.5°
H21	C2	H23	109.5°	109.5°
H22	C2	H23	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	AS	O2	C1	118.6°	120.0°
O1	AS	O2	C2	127.2°	120.0°
O1	AS	C1	C2	111.2°	120.0°
O1	AS	C1	H11	180.0°	60.0°
O1	AS	C1	H12	60.0°	180.0°
O1	AS	C1	H13	60.0°	60.0°
O1	AS	C2	H21	180.0°	60.0°
O1	AS	C2	H22	60.0°	180.0°
O1	AS	C2	H23	60.0°	60.0°
O2	AS	C1	C2	120.8°	120.0°
O2	AS	C1	H11	52.0°	180.0°
O2	AS	C1	H12	67.9°	60.0°
O2	AS	C1	H13	172.0°	60.0°
O2	AS	C2	H21	47.6°	60.0°
O2	AS	C2	H22	167.6°	60.0°
O2	AS	C2	H23	72.5°	180.0°
AS	C1	H11	H12	120.0°	120.0°
AS	C1	H11	H13	120.0°	120.0°
AS	C1	H12	H13	120.0°	120.0°
C1	AS	C2	H21	73.9°	180.0°
C1	AS	C2	H22	46.1°	60.0°
C1	AS	C2	H23	166.0°	60.0°
C2	AS	C1	H11	68.8°	60.0°
C2	AS	C1	H12	171.2°	60.0°
C2	AS	C1	H13	51.2°	180.0°
AS	C2	H21	H22	120.0°	120.0°
AS	C2	H21	H23	120.0°	120.0°
AS	C2	H22	H23	120.0°	120.0°
H11	C1	H12	H13	120.0°	120.0°
H21	C2	H22	H23	120.0°	120.0°

218853

PDB entries from 2024-04-24

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