Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3e2dcb0baacd843d3dbac9a1a1650d8a",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.11,
"b": 82.11,
"c": 134.68,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.270,2.270],
"number_observations": 499305,
"number_observations_unique": 24944,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.330,2.270],
"number_observations": 37774,
"number_observations_unique": 1808,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.085
},
{
"type": "R(meas)",
"value": 2.137
},
{
"type": "R(pim)",
"value": 0.466
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.900
},
{
"type": "CC(1/2)",
"value": 0.781
}
]
},
{
"resolution_limits": [39.270,10.150],
"number_observations": 4616,
"number_observations_unique": 323,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 36.500
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}