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Summary Geometry Related PDB entries

F4S

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
S1	FE1	sing	0.00Å	2.29Å
S1	FE2	sing	0.00Å	2.28Å
S1	FE4	sing	0.00Å	2.28Å
FE1	S2	sing	0.00Å	2.27Å
S2	FE2	sing	0.00Å	2.28Å
S2	FE3	sing	0.00Å	2.29Å
FE2	S3	sing	0.00Å	2.27Å
S3	FE3	sing	0.00Å	2.29Å
S3	FE4	sing	0.00Å	2.31Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
FE1	S1	FE2	69.2°	90.0°
FE1	S1	FE4	71.5°	90.0°
S1	FE1	S2	106.0°	90.0°
FE2	S1	FE4	77.2°	90.0°
S1	FE2	S2	105.8°	90.0°
S1	FE2	S3	103.1°	90.0°
S1	FE4	S3	101.7°	90.0°
FE1	S2	FE2	69.6°	90.0°
FE1	S2	FE3	101.0°	90.0°
FE2	S2	FE3	72.8°	90.0°
S2	FE2	S3	102.1°	90.0°
S2	FE3	S3	101.1°	90.0°
FE2	S3	FE3	73.1°	90.0°
FE2	S3	FE4	76.7°	90.0°
FE3	S3	FE4	118.7°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
FE1	S1	FE2	FE4	74.8°	90.0°
FE1	S1	FE2	S2	23.3°	90.0°
S1	FE1	S2	FE3	90.3°	90.0°
FE1	S1	FE2	S3	83.6°	90.0°
FE1	S1	FE4	S3	80.6°	90.0°
S1	FE2	S2	S3	107.6°	90.0°
S1	FE2	S2	FE3	132.6°	90.0°
S1	FE2	S3	FE3	134.7°	90.0°
FE2	S1	FE4	S3	8.5°	90.0°
FE4	S1	FE1	S2	106.5°	90.0°
FE4	S1	FE2	S2	98.1°	90.0°
S1	FE4	S3	FE3	70.5°	90.0°
FE1	S2	FE2	FE3	109.1°	90.0°
FE1	S2	FE2	S3	84.1°	90.0°
FE1	S2	FE3	S3	39.7°	90.0°
FE2	S2	FE3	S3	24.7°	90.0°
S2	FE2	S3	FE4	101.0°	90.0°
S2	FE3	S3	FE4	39.1°	90.0°
FE2	S3	FE3	FE4	63.9°	90.0°

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