Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80d8a5d8e5edcb115a43518a656da744",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 47.329,
"b": 67.277,
"c": 89.574,
"alpha": 90.00,
"beta": 95.21,
"gamma": 90.00
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.973,1.6950],
"number_observations_unique": 61241,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 24.160
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 6.496
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.800,1.700],
"number_observations_unique": 9058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "R(meas)",
"value": 0.130
},
{
"type": "I/SigI",
"value": 9.350
},
{
"type": "Completeness",
"value": 90.900
},
{
"type": "Redundancy",
"value": 5.128
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
{
"resolution_limits": [1.920,1.800],
"number_observations_unique": 9425,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 14.720
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.910
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [2.080,1.920],
"number_observations_unique": 8780,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 19.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.614
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [2.270,2.080],
"number_observations_unique": 8065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 24.750
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.912
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.540,2.270],
"number_observations_unique": 7277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 28.190
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.565
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.930,2.540],
"number_observations_unique": 6479,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 32.770
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.874
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.590,2.930],
"number_observations_unique": 5474,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 36.740
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.596
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [5.060,3.590],
"number_observations_unique": 4262,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 39.750
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.586
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [33.973,5.060],
"number_observations_unique": 2421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 40.230
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.581
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}