Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9fb23e590775c3e5ae55641b6c6b683d",
"space_group_name": "P 1",
"unit_cell": {
"a": 65.244,
"b": 81.754,
"c": 102.797,
"alpha": 92.31,
"beta": 91.05,
"gamma": 113.37
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.950,2.010],
"number_observations": 216621,
"number_observations_unique": 121248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 93.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.120,2.010],
"number_observations": 33001,
"number_observations_unique": 18085,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.106
},
{
"type": "R(meas)",
"value": 1.563
},
{
"type": "R(pim)",
"value": 1.105
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.395
}
]
},
{
"resolution_limits": [74.950,6.350],
"number_observations": 6825,
"number_observations_unique": 3868,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 8.700
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}