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ID of heme	Distortion Sort by saddling ruffling doming breathing	Axial ligands on heme		Function & structure
3oa8-A-401	`sad. +0.53 ruf. -0.56 dom. +0.15 bre. -0.04`	HIS	chainID: A, resSeq: 187, molecule: SoxA	transferase oligomeric count: 6 pocket vol.: 409.0 Å³ d(Fe-oop): 0.049 Å
3oa8-A-401	`sad. +0.53 ruf. -0.56 dom. +0.15 bre. -0.04`	CSS	chainID: A, resSeq: 236, molecule: SoxA
3oa8-B-401	`sad. +0.03 ruf. -0.64 dom. -0.08 bre. -0.17`	HIS	chainID: B, resSeq: 129, molecule: SoxX	electron transporter oligomeric count: 6 pocket vol.: 438.0 Å³ d(Fe-oop): 0.056 Å
3oa8-B-401	`sad. +0.03 ruf. -0.64 dom. -0.08 bre. -0.17`	MET	chainID: B, resSeq: 178, molecule: SoxX
3oa8-C-401	`sad. +0.57 ruf. -0.52 dom. +0.03 bre. -0.08`	HIS	chainID: C, resSeq: 187, molecule: SoxA	transferase oligomeric count: 6 pocket vol.: 430.0 Å³ d(Fe-oop): 0.031 Å
3oa8-C-401	`sad. +0.57 ruf. -0.52 dom. +0.03 bre. -0.08`	CSS	chainID: C, resSeq: 236, molecule: SoxA
3oa8-D-401	`sad. +0.05 ruf. -0.52 dom. -0.07 bre. -0.15`	HIS	chainID: D, resSeq: 129, molecule: SoxX	electron transporter oligomeric count: 6 pocket vol.: 413.0 Å³ d(Fe-oop): 0.032 Å
3oa8-D-401	`sad. +0.05 ruf. -0.52 dom. -0.07 bre. -0.15`	MET	chainID: D, resSeq: 178, molecule: SoxX
3oa8-E-401	`sad. +0.51 ruf. -0.47 dom. +0.13 bre. -0.09`	HIS	chainID: E, resSeq: 187, molecule: SoxA	transferase oligomeric count: 6 pocket vol.: 458.0 Å³ d(Fe-oop): 0.068 Å
3oa8-E-401	`sad. +0.51 ruf. -0.47 dom. +0.13 bre. -0.09`	CSS	chainID: E, resSeq: 236, molecule: SoxA
3oa8-F-401	`sad. -0.00 ruf. -0.61 dom. +0.00 bre. -0.15`	HIS	chainID: F, resSeq: 129, molecule: SoxX	electron transporter oligomeric count: 6 pocket vol.: 386.0 Å³ d(Fe-oop): 0.036 Å
3oa8-F-401	`sad. -0.00 ruf. -0.61 dom. +0.00 bre. -0.15`	MET	chainID: F, resSeq: 178, molecule: SoxX
3ocd-A-401	`sad. +0.19 ruf. -0.87 dom. +0.56 bre. -0.19`	HIS	chainID: A, resSeq: 187, molecule: SoxA	transferase oligomeric count: 2 pocket vol.: 490.0 Å³ d(Fe-oop): 0.116 Å
3ocd-A-401	`sad. +0.19 ruf. -0.87 dom. +0.56 bre. -0.19`	MET	chainID: A, resSeq: 236, molecule: SoxA
3ocd-B-401	`sad. +0.06 ruf. -0.61 dom. +0.04 bre. -0.31`	HIS	chainID: B, resSeq: 129, molecule: SoxX	electron transporter oligomeric count: 2 pocket vol.: 418.0 Å³ d(Fe-oop): 0.054 Å
3ocd-B-401	`sad. +0.06 ruf. -0.61 dom. +0.04 bre. -0.31`	MET	chainID: B, resSeq: 178, molecule: SoxX
3ocd-C-401	`sad. +0.64 ruf. -0.20 dom. +0.07 bre. -0.23`	HIS	chainID: C, resSeq: 187, molecule: SoxA	transferase oligomeric count: 2 pocket vol.: 393.0 Å³ d(Fe-oop): 0.039 Å
3ocd-C-401	`sad. +0.64 ruf. -0.20 dom. +0.07 bre. -0.23`	MET	chainID: C, resSeq: 236, molecule: SoxA
3ocd-D-401	`sad. +0.41 ruf. -0.97 dom. +0.17 bre. -0.11`	HIS	chainID: D, resSeq: 129, molecule: SoxX	electron transporter oligomeric count: 2 pocket vol.: 441.0 Å³ d(Fe-oop): 0.035 Å
3ocd-D-401	`sad. +0.41 ruf. -0.97 dom. +0.17 bre. -0.11`	MET	chainID: D, resSeq: 178, molecule: SoxX
3odq-A-142	`sad. +0.17 ruf. -0.40 dom. -0.21 bre. -0.15`	HIS	chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 550.0 Å³ d(Fe-oop): 0.038 Å
3odq-A-142	`sad. +0.17 ruf. -0.40 dom. -0.21 bre. -0.15`	Not assigned.
3odq-B-147	`sad. +0.33 ruf. -0.23 dom. -0.20 bre. -0.23`	HIS	chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta	oxygen carrier oligomeric count: 4 pocket vol.: 585.0 Å³ d(Fe-oop): 0.061 Å
3odq-B-147	`sad. +0.33 ruf. -0.23 dom. -0.20 bre. -0.23`	Not assigned.
3odq-C-142	`sad. +0.17 ruf. -0.40 dom. -0.21 bre. -0.15`	HIS	chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 499.0 Å³ d(Fe-oop): 0.040 Å
3odq-C-142	`sad. +0.17 ruf. -0.40 dom. -0.21 bre. -0.15`	Not assigned.
3odq-D-147	`sad. +0.33 ruf. -0.23 dom. -0.20 bre. -0.23`	HIS	chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta	oxygen carrier oligomeric count: 4 pocket vol.: 588.0 Å³ d(Fe-oop): 0.060 Å
3odq-D-147	`sad. +0.33 ruf. -0.23 dom. -0.20 bre. -0.23`	Not assigned.
3oft-A-417	`sad. -0.30 ruf. -0.68 dom. +0.02 bre. -0.20`	CYS	chainID: A, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 400.0 Å³ d(Fe-oop): 0.075 Å
3oft-A-417	`sad. -0.30 ruf. -0.68 dom. +0.02 bre. -0.20`	HOH	chainID: A, resSeq: 398, molecule: water
3oft-B-417	`sad. -0.35 ruf. -0.61 dom. -0.01 bre. -0.20`	CYS	chainID: B, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 400.0 Å³ d(Fe-oop): 0.087 Å
3oft-B-417	`sad. -0.35 ruf. -0.61 dom. -0.01 bre. -0.20`	HOH	chainID: B, resSeq: 399, molecule: water
3oft-C-417	`sad. -0.30 ruf. -0.56 dom. -0.08 bre. -0.18`	CYS	chainID: C, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 412.0 Å³ d(Fe-oop): 0.079 Å
3oft-C-417	`sad. -0.30 ruf. -0.56 dom. -0.08 bre. -0.18`	HOH	chainID: C, resSeq: 398, molecule: water
3ofu-A-417	`sad. -0.36 ruf. -0.92 dom. +0.17 bre. +0.07`	CYS	chainID: A, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 382.0 Å³ d(Fe-oop): 0.094 Å
3ofu-A-417	`sad. -0.36 ruf. -0.92 dom. +0.17 bre. +0.07`	Not assigned.
3ofu-B-417	`sad. -0.34 ruf. -0.82 dom. +0.18 bre. +0.14`	CYS	chainID: B, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 407.0 Å³ d(Fe-oop): 0.076 Å
3ofu-B-417	`sad. -0.34 ruf. -0.82 dom. +0.18 bre. +0.14`	Not assigned.
3ofu-C-417	`sad. -0.31 ruf. -0.96 dom. +0.09 bre. +0.06`	CYS	chainID: C, resSeq: 345, molecule: Cytochrome P450	oxidoreductase oligomeric count: 1 pocket vol.: 404.0 Å³ d(Fe-oop): 0.095 Å
3ofu-C-417	`sad. -0.31 ruf. -0.96 dom. +0.09 bre. +0.06`	Not assigned.

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