Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8a5badadbcf86874c0b08b849db04443",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 90.722,
"b": 23.066,
"c": 48.395,
"alpha": 90.00,
"beta": 109.04,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.090,1.840],
"number_observations": 32240,
"number_observations_unique": 8079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 36.300
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.840],
"number_observations": 1302,
"number_observations_unique": 402,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 13.800
},
{
"type": "Completeness",
"value": 78.900
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [38.090,9.030],
"number_observations": 279,
"number_observations_unique": 84,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.010
},
{
"type": "R(meas)",
"value": 0.012
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 45.600
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}