Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6b3ebd7f3f15756f328514b10811b378",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 63.713,
"b": 63.713,
"c": 242.432,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.490,2.250],
"number_observations": 349118,
"number_observations_unique": 24875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 29.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 14.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.320,2.250],
"number_observations": 30387,
"number_observations_unique": 2203,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.336
},
{
"type": "R(meas)",
"value": 1.386
},
{
"type": "R(pim)",
"value": 0.367
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.945
}
]
},
{
"resolution_limits": [48.490,8.990],
"number_observations": 4615,
"number_observations_unique": 469,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 69.500
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}