Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ea1392a86c9b67a9d665c3aa91296ab3",
"space_group_name": "I 2 3",
"unit_cell": {
"a": 176.755,
"b": 176.755,
"c": 176.755,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.680,2.170],
"number_observations": 499588,
"number_observations_unique": 48456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.170],
"number_observations": 41659,
"number_observations_unique": 4186,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.533
},
{
"type": "R(meas)",
"value": 1.616
},
{
"type": "R(pim)",
"value": 0.508
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.668
}
]
},
{
"resolution_limits": [37.680,8.950],
"number_observations": 7512,
"number_observations_unique": 742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 17.700
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}