Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a40ab09ab5f43fd41c77b76d3af63ad",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.900,
"b": 197.612,
"c": 95.344,
"alpha": 90.0,
"beta": 112.7,
"gamma": 90.0
},
"wavelengths": [1.11580],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [197.610,2.760],
"number_observations_unique": 64543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.158
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 10.400
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.830,2.760],
"quality_factors": [
{
"type": "R(merge)",
"value": 3.689
},
{
"type": "R(meas)",
"value": 4.055
},
{
"type": "R(pim)",
"value": 1.637
},
{
"type": "Completeness",
"value": 74.600
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.248
}
]
},
{
"resolution_limits": [197.610,12.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}