Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e29649ed272acf71220ec78780ebf3b4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.26,
"b": 105.37,
"c": 110.26,
"alpha": 90.00,
"beta": 108.69,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.2,1.780],
"number_observations_unique": 144987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.183
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 9.200
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.810,1.780],
"number_observations_unique": 6982,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.675
},
{
"type": "R(meas)",
"value": 1.852
},
{
"type": "R(pim)",
"value": 0.775
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.342
}
]
},
{
"resolution_limits": [36.160,9.760],
"number_observations_unique": 924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}