Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "578f89ee51b1c730ae6690e8ec3142a6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 59.678,
"b": 153.119,
"c": 108.794,
"alpha": 90.00,
"beta": 90.66,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.1005,1.850],
"number_observations_unique": 163788,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 12.300
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.850],
"number_observations": 73988,
"number_observations_unique": 8095,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.906
},
{
"type": "R(meas)",
"value": 3.068
},
{
"type": "R(pim)",
"value": 0.969
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 9.100
},
{
"type": "CC(1/2)",
"value": 0.703
}
]
}
]
}