Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "29101156dbb27d356b53303ecffaa603",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.739,
"b": 68.328,
"c": 138.512,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.540,1.940],
"number_observations": 327111,
"number_observations_unique": 48328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.240
},
{
"type": "R(meas)",
"value": 0.261
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.958
}
]
},
"refln_shells": [
{
"resolution_limits": [1.990,1.940],
"number_observations": 20609,
"number_observations_unique": 3164,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.369
},
{
"type": "R(meas)",
"value": 3.662
},
{
"type": "R(pim)",
"value": 1.422
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.289
}
]
},
{
"resolution_limits": [138.540,9.100],
"number_observations": 3124,
"number_observations_unique": 566,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 39.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.753
}
]
}
]
}