Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5332d0fb0026c2acf7213ecd0b7fa9ac",
"space_group_name": "P 6 2 2",
"unit_cell": {
"a": 74.620,
"b": 74.620,
"c": 73.782,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.610,2.050],
"number_observations": 263835,
"number_observations_unique": 7949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "R(meas)",
"value": 0.152
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 17.400
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 33.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.050],
"number_observations": 12619,
"number_observations_unique": 494,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.549
},
{
"type": "R(meas)",
"value": 1.584
},
{
"type": "R(pim)",
"value": 0.301
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 81.700
},
{
"type": "Redundancy",
"value": 25.500
},
{
"type": "CC(1/2)",
"value": 0.488
}
]
},
{
"resolution_limits": [48.610,8.950],
"number_observations": 3650,
"number_observations_unique": 138,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 37.700
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 26.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}