Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "58707ecf34f049370228fcb69106be21",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 66.669,
"b": 109.556,
"c": 77.729,
"alpha": 90.00,
"beta": 92.17,
"gamma": 90.00
},
"wavelengths": [0.97945],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.840,3.190],
"number_observations": 127487,
"number_observations_unique": 18399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.497
},
{
"type": "R(pim)",
"value": 0.203
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
"refln_shells": [
{
"resolution_limits": [3.410,3.190],
"number_observations": 21860,
"number_observations_unique": 3280,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.994
},
{
"type": "R(pim)",
"value": 1.245
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.254
}
]
},
{
"resolution_limits": [38.840,9.030],
"number_observations": 5687,
"number_observations_unique": 839,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 23.200
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}