Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2f24cea7026a7cd1d996b4741826586a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 55.219,
"b": 56.213,
"c": 101.635,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.020,2.580],
"number_observations": 67722,
"number_observations_unique": 10382,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.190
},
{
"type": "R(meas)",
"value": 0.207
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.580],
"number_observations": 4715,
"number_observations_unique": 723,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.123
},
{
"type": "R(meas)",
"value": 1.219
},
{
"type": "R(pim)",
"value": 0.468
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.707
}
]
},
{
"resolution_limits": [29.020,11.560],
"number_observations": 770,
"number_observations_unique": 138,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 40.700
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}