Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e3f3e6b855f7e62a6c98faf960bab584",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.02,
"b": 49.06,
"c": 107.84,
"alpha": 91.13,
"beta": 93.53,
"gamma": 95.70
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.800,2.060],
"number_observations": 112351,
"number_observations_unique": 56594,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.060],
"number_observations": 8241,
"number_observations_unique": 4139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.407
},
{
"type": "R(pim)",
"value": 0.367
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.811
}
]
},
{
"resolution_limits": [53.800,9.210],
"number_observations": 1298,
"number_observations_unique": 623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}