Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "469ac343197366ce37e1bbd3a91810ae",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 71.297,
"b": 33.520,
"c": 115.599,
"alpha": 90.0,
"beta": 91.8,
"gamma": 90.0
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.6310,1.790],
"number_observations_unique": 25832,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 8.400
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.830,1.790],
"number_observations_unique": 1292,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.623
},
{
"type": "R(meas)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.712
},
{
"type": "Completeness",
"value": 83.200
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.665
}
]
},
{
"resolution_limits": [10.0,8.0],
"number_observations_unique": 237,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}