Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ba202731cf947d8f72f51a5e259eb72",
"space_group_name": "P 1",
"unit_cell": {
"a": 66.489,
"b": 72.409,
"c": 118.515,
"alpha": 94.89,
"beta": 98.60,
"gamma": 115.59
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [115.500,3.030],
"number_observations": 65596,
"number_observations_unique": 37042,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [3.110,3.030],
"number_observations": 4985,
"number_observations_unique": 2747,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.635
},
{
"type": "R(meas)",
"value": 0.898
},
{
"type": "R(pim)",
"value": 0.635
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.610
}
]
},
{
"resolution_limits": [115.500,13.550],
"number_observations": 817,
"number_observations_unique": 420,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 21.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
}
]
}