Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "020c9ecbe1bb5d1f6cff946ce455c2ae",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 78.429,
"b": 129.300,
"c": 78.651,
"alpha": 90.000,
"beta": 106.048,
"gamma": 90.000
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.254,2.19],
"number_observations_unique": 76424,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3247
},
{
"type": "R(meas)",
"value": 0.3498
},
{
"type": "R(pim)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 6.92
},
{
"type": "Completeness",
"value": 98.51
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.268,2.19],
"number_observations_unique": 56392,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.636
},
{
"type": "R(meas)",
"value": 2.832
},
{
"type": "R(pim)",
"value": 1.028
},
{
"type": "I/SigI",
"value": 1.16
},
{
"type": "Completeness",
"value": 96.78
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.405
}
]
}
]
}