Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "84c069f88811fe3373b2e5ae6ded4196",
"space_group_name": "P 1",
"unit_cell": {
"a": 59.479,
"b": 70.417,
"c": 85.584,
"alpha": 102.71,
"beta": 95.94,
"gamma": 112.61
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.640,1.920],
"number_observations": 298977,
"number_observations_unique": 89117,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 95.800
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.960,1.920],
"number_observations": 12578,
"number_observations_unique": 4247,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.365
},
{
"type": "R(meas)",
"value": 1.675
},
{
"type": "R(pim)",
"value": 0.951
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 89.200
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.474
}
]
},
{
"resolution_limits": [81.640,10.360],
"number_observations": 2300,
"number_observations_unique": 593,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 33.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}