Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "40e563610967176cafc2b4125644ac4e",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 46.553,
"b": 85.611,
"c": 89.612,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.00,2.00],
"number_observations_unique": 12360,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.15,2.00],
"number_observations": 2351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.331
},
{
"type": "Redundancy",
"value": 5.400
}
]
},
{
"resolution_limits": [2.37,2.15],
"number_observations": 2444,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "Redundancy",
"value": 5.700
}
]
},
{
"resolution_limits": [2.71,2.37],
"number_observations": 2467,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "Redundancy",
"value": 5.800
}
]
},
{
"resolution_limits": [3.42,2.71],
"number_observations": 2494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "Redundancy",
"value": 5.900
}
]
},
{
"resolution_limits": [20.00,3.42],
"number_observations": 2604,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "Redundancy",
"value": 5.800
}
]
}
]
}