Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6740b538f7c049f4d5c0c7ed82087180",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.250,
"b": 33.951,
"c": 59.713,
"alpha": 90.00,
"beta": 95.32,
"gamma": 90.00
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.070,1.150],
"number_observations": 210238,
"number_observations_unique": 40702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 24.000
},
{
"type": "Completeness",
"value": 76.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations": 150,
"number_observations_unique": 148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 5.600
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.957
}
]
},
{
"resolution_limits": [37.070,6.310],
"number_observations": 2016,
"number_observations_unique": 353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 75.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.700
}
]
}
]
}