Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a360405946bbb45e6ec5bcc2c982fba9",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 77.263,
"b": 127.758,
"c": 131.789,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.360,2.400],
"number_observations": 220860,
"number_observations_unique": 51446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.470,2.400],
"number_observations": 18360,
"number_observations_unique": 4399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.599
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.753
}
]
},
{
"resolution_limits": [26.360,9.900],
"number_observations": 2223,
"number_observations_unique": 660,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 18.800
},
{
"type": "Completeness",
"value": 80.900
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
}
]
}