Table 1.

Data collection and phasing statistics

SeMet
Data collection statistics
X-ray sourceSPring-8 BL41XU
Wavelength (Å)
    Peak0.97941
    Edge0.97914
    Remote0.96410
Unit cell dimensions (Å,°)a = 78.23, b = 90.16, c = 252.0, α = β = γ = 90
Resolution (Å)50–2.71 (2.76–2.71)50–2.72 (2.77–2.72)50–2.67 (2.72–2.67)
Unique reflections48 596 (2406)47 508 (2025)40 354 (1747)
Redundancy9.6 (6.0)4.2 (2.3)3.8 (2.0)
Completeness (%)99.7 (99.2)95.5 (83.9)93.3 (67.5)
I/σ(I)23.3 (3.17)10.6 (1.32)8.17 (4.81)
Rsym0.127 (0.383)0.105 (0.384)0.112 (0.424)
Phasing statistics
No. of Se sites29
Phasing power
    Iso (cen./acen.)0.163/0.1730.333/0.240
    Ano0.8830.2520.421
Rcullis
    Iso (cen./acen.)0.959/0.8581.021/1.168
    Ano0.8660.9850.964
Mean FOM
    Cen./Acen.0.163/0.248
SeMet
Data collection statistics
X-ray sourceSPring-8 BL41XU
Wavelength (Å)
    Peak0.97941
    Edge0.97914
    Remote0.96410
Unit cell dimensions (Å,°)a = 78.23, b = 90.16, c = 252.0, α = β = γ = 90
Resolution (Å)50–2.71 (2.76–2.71)50–2.72 (2.77–2.72)50–2.67 (2.72–2.67)
Unique reflections48 596 (2406)47 508 (2025)40 354 (1747)
Redundancy9.6 (6.0)4.2 (2.3)3.8 (2.0)
Completeness (%)99.7 (99.2)95.5 (83.9)93.3 (67.5)
I/σ(I)23.3 (3.17)10.6 (1.32)8.17 (4.81)
Rsym0.127 (0.383)0.105 (0.384)0.112 (0.424)
Phasing statistics
No. of Se sites29
Phasing power
    Iso (cen./acen.)0.163/0.1730.333/0.240
    Ano0.8830.2520.421
Rcullis
    Iso (cen./acen.)0.959/0.8581.021/1.168
    Ano0.8660.9850.964
Mean FOM
    Cen./Acen.0.163/0.248

The numbers in parentheses are for the last shell.

formula.

formula.

Table 1.

Data collection and phasing statistics

SeMet
Data collection statistics
X-ray sourceSPring-8 BL41XU
Wavelength (Å)
    Peak0.97941
    Edge0.97914
    Remote0.96410
Unit cell dimensions (Å,°)a = 78.23, b = 90.16, c = 252.0, α = β = γ = 90
Resolution (Å)50–2.71 (2.76–2.71)50–2.72 (2.77–2.72)50–2.67 (2.72–2.67)
Unique reflections48 596 (2406)47 508 (2025)40 354 (1747)
Redundancy9.6 (6.0)4.2 (2.3)3.8 (2.0)
Completeness (%)99.7 (99.2)95.5 (83.9)93.3 (67.5)
I/σ(I)23.3 (3.17)10.6 (1.32)8.17 (4.81)
Rsym0.127 (0.383)0.105 (0.384)0.112 (0.424)
Phasing statistics
No. of Se sites29
Phasing power
    Iso (cen./acen.)0.163/0.1730.333/0.240
    Ano0.8830.2520.421
Rcullis
    Iso (cen./acen.)0.959/0.8581.021/1.168
    Ano0.8660.9850.964
Mean FOM
    Cen./Acen.0.163/0.248
SeMet
Data collection statistics
X-ray sourceSPring-8 BL41XU
Wavelength (Å)
    Peak0.97941
    Edge0.97914
    Remote0.96410
Unit cell dimensions (Å,°)a = 78.23, b = 90.16, c = 252.0, α = β = γ = 90
Resolution (Å)50–2.71 (2.76–2.71)50–2.72 (2.77–2.72)50–2.67 (2.72–2.67)
Unique reflections48 596 (2406)47 508 (2025)40 354 (1747)
Redundancy9.6 (6.0)4.2 (2.3)3.8 (2.0)
Completeness (%)99.7 (99.2)95.5 (83.9)93.3 (67.5)
I/σ(I)23.3 (3.17)10.6 (1.32)8.17 (4.81)
Rsym0.127 (0.383)0.105 (0.384)0.112 (0.424)
Phasing statistics
No. of Se sites29
Phasing power
    Iso (cen./acen.)0.163/0.1730.333/0.240
    Ano0.8830.2520.421
Rcullis
    Iso (cen./acen.)0.959/0.8581.021/1.168
    Ano0.8660.9850.964
Mean FOM
    Cen./Acen.0.163/0.248

The numbers in parentheses are for the last shell.

formula.

formula.

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