Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "81087f06338bdf3335b21cb6319545ff",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.286,
"b": 145.536,
"c": 97.919,
"alpha": 90.00,
"beta": 92.19,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.460,2.250],
"number_observations": 190054,
"number_observations_unique": 61615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.250],
"number_observations": 13031,
"number_observations_unique": 4330,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.030
},
{
"type": "R(pim)",
"value": 0.675
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [43.460,10.310],
"number_observations": 1814,
"number_observations_unique": 566,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 79.700
},
{
"type": "Redundancy",
"value": 3.200
}
]
}
]
}