Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "890da317c40ab83f0ed38effd36955cb",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 64.608,
"b": 68.258,
"c": 276.007,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.000,2.190],
"number_observations": 820448,
"number_observations_unique": 63449,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 15.600
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.190],
"number_observations": 52086,
"number_observations_unique": 4295,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.323
},
{
"type": "R(meas)",
"value": 2.426
},
{
"type": "R(pim)",
"value": 0.686
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.592
}
]
},
{
"resolution_limits": [138.000,10.040],
"number_observations": 8861,
"number_observations_unique": 796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 48.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}