Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6fdb6aad049775f54ba5319303322850",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 76.865,
"b": 78.386,
"c": 92.043,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98011],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.140,2.150],
"number_observations_unique": 30915,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "R(meas)",
"value": 0.169
},
{
"type": "R(pim)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.220,2.150],
"number_observations": 20267,
"number_observations_unique": 2594,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.996
},
{
"type": "R(meas)",
"value": 1.066
},
{
"type": "R(pim)",
"value": 0.373
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 7.800
},
{
"type": "CC(1/2)",
"value": 0.769
}
]
},
{
"resolution_limits": [47.140,8.860],
"number_observations": 3615,
"number_observations_unique": 521,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 31.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}