Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2c2b8f753a758f8687a4116016ffcad",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.733,
"b": 95.733,
"c": 45.741,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.260,1.420],
"number_observations": 496399,
"number_observations_unique": 39250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.440,1.420],
"number_observations": 17359,
"number_observations_unique": 1952,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.386
},
{
"type": "R(meas)",
"value": 3.597
},
{
"type": "R(pim)",
"value": 1.201
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 8.900
},
{
"type": "CC(1/2)",
"value": 0.314
}
]
},
{
"resolution_limits": [41.260,7.770],
"number_observations": 3072,
"number_observations_unique": 263,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 53.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}