Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ba363925321988fb5a1f95d7f7259b5",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.611,
"b": 68.169,
"c": 138.765,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.740,1.900],
"number_observations": 344530,
"number_observations_unique": 51322,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.179
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations": 19031,
"number_observations_unique": 3209,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.793
},
{
"type": "R(meas)",
"value": 3.067
},
{
"type": "R(pim)",
"value": 1.253
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.345
}
]
},
{
"resolution_limits": [138.740,9.110],
"number_observations": 3157,
"number_observations_unique": 562,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 54.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
}
]
}