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Summary Geometry Related PDB entries

9S8

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
S1	FE2	sing	0.00Å	2.14Å
S1	FE4	sing	0.00Å	2.13Å
S1	FE9	sing	0.00Å	2.16Å
FE2	S3	sing	0.00Å	2.25Å
S3	FE4	sing	0.00Å	2.21Å
FE4	S5	sing	0.00Å	2.25Å
FE4	S7	sing	0.00Å	2.14Å
S5	FE6	sing	0.00Å	2.23Å
FE6	S7	sing	0.00Å	2.12Å
S7	FE9	sing	0.00Å	2.16Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
FE2	S1	FE4	105.9°	90.0°
FE2	S1	FE9	119.5°	90.0°
S1	FE2	S3	69.2°	90.0°
FE4	S1	FE9	82.0°	90.0°
S1	FE4	S3	70.1°	90.0°
S1	FE4	S5	72.0°	90.0°
S1	FE4	S7	96.5°	90.0°
S1	FE9	S7	95.1°	90.0°
FE2	S3	FE4	99.9°	90.0°
S3	FE4	S5	112.0°	90.0°
S3	FE4	S7	160.5°	90.0°
S5	FE4	S7	75.2°	90.0°
FE4	S5	FE6	98.7°	90.0°
FE4	S7	FE6	105.5°	90.0°
FE4	S7	FE9	81.7°	90.0°
S5	FE6	S7	76.0°	90.0°
FE6	S7	FE9	104.6°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
FE2	S1	FE4	FE9	118.5°	90.0°
FE2	S1	FE4	S3	30.4°	90.0°
FE2	S1	FE4	S5	152.8°	90.0°
FE2	S1	FE4	S7	135.0°	90.0°
FE2	S1	FE9	S7	120.2°	90.0°
S1	FE4	S3	S5	60.0°	90.0°
S1	FE4	S3	S7	48.6°	90.0°
S1	FE4	S5	S7	102.0°	90.0°
S1	FE4	S5	FE6	117.7°	90.0°
S1	FE4	S7	FE6	86.4°	90.0°
FE4	S1	FE9	S7	16.4°	90.0°
FE9	S1	FE2	S3	119.8°	90.0°
FE9	S1	FE4	S3	148.8°	90.0°
FE9	S1	FE4	S5	88.7°	90.0°
S1	FE9	S7	FE6	87.6°	90.0°
FE2	S3	FE4	S5	88.1°	90.0°
FE2	S3	FE4	S7	20.5°	90.0°
S3	FE4	S5	S7	160.9°	90.0°
S3	FE4	S5	FE6	176.6°	90.0°
S3	FE4	S7	FE6	131.6°	90.0°
S3	FE4	S7	FE9	28.7°	90.0°
S5	FE4	S7	FE6	16.9°	90.0°
S5	FE4	S7	FE9	86.0°	90.0°
FE4	S7	FE6	FE9	85.2°	90.0°
S5	FE6	S7	FE9	68.2°	90.0°

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