Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "51cde9115947571653c263fb3386026c",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 91.621,
"b": 91.604,
"c": 71.623,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.044,1.739],
"number_observations_unique": 17430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 93.200
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.983,1.739],
"number_observations": 5092,
"number_observations_unique": 872,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.896
},
{
"type": "R(meas)",
"value": 0.984
},
{
"type": "R(pim)",
"value": 0.401
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 67.300
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.709
}
]
},
{
"resolution_limits": [48.044,5.932],
"number_observations": 5461,
"number_observations_unique": 871,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 51.700
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}