Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3a74cee2d33bcc841dc7ed3ddd8008f9",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.693,
"b": 88.693,
"c": 39.265,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,1.020],
"number_observations": 986856,
"number_observations_unique": 155104,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.040,1.020],
"number_observations": 41060,
"number_observations_unique": 7521,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.599
},
{
"type": "R(meas)",
"value": 1.767
},
{
"type": "R(pim)",
"value": 0.736
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.574
}
]
},
{
"resolution_limits": [44.350,5.590],
"number_observations": 7001,
"number_observations_unique": 1030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}