Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ac45415d326e49f8f4415fad2086772c",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 59.77,
"b": 59.77,
"c": 214.23,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.610,1.520],
"number_observations": 672004,
"number_observations_unique": 69626,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.560,1.520],
"number_observations": 42834,
"number_observations_unique": 5036,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.223
},
{
"type": "R(meas)",
"value": 2.367
},
{
"type": "R(pim)",
"value": 0.807
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.499
}
]
},
{
"resolution_limits": [46.610,6.800],
"number_observations": 8082,
"number_observations_unique": 932,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 60.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}