Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "82548b57b9e1263b782387f83606c679",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 57.66,
"b": 57.66,
"c": 183.78,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.020,1.700],
"number_observations": 447167,
"number_observations_unique": 17637,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.175
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 21932,
"number_observations_unique": 897,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.932
},
{
"type": "R(meas)",
"value": 1.973
},
{
"type": "R(pim)",
"value": 0.390
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.500
},
{
"type": "CC(1/2)",
"value": 0.772
}
]
},
{
"resolution_limits": [55.020,9.000],
"number_observations": 3318,
"number_observations_unique": 161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 33.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}