Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fb7c8d56cd430bcbc8099d39f4e3eb71",
"space_group_name": "P 43",
"unit_cell": {
"a": 61.003,
"b": 61.003,
"c": 35.331,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.150,1.890],
"number_observations": 145177,
"number_observations_unique": 10634,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.930,1.890],
"number_observations": 9643,
"number_observations_unique": 680,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.099
},
{
"type": "R(meas)",
"value": 5.288
},
{
"type": "R(pim)",
"value": 1.395
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
},
{
"resolution_limits": [43.150,9.070],
"number_observations": 1183,
"number_observations_unique": 112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 57.900
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}