Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e831f4e0905d51719205cf9fb8fffa04",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 109.453,
"b": 133.066,
"c": 221.192,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.70],
"number_observations_unique": 89259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "I/SigI",
"value": 16.844
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.80,2.70],
"number_observations_unique": 8835,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.833
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.10
}
]
},
{
"resolution_limits": [2.91,2.80],
"number_observations_unique": 8816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.635
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.20
}
]
},
{
"resolution_limits": [3.04,2.91],
"number_observations_unique": 8837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.478
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.30
}
]
},
{
"resolution_limits": [3.20,3.04],
"number_observations_unique": 8833,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.318
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.50
}
]
},
{
"resolution_limits": [3.40,3.20],
"number_observations_unique": 8860,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.209
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.60
}
]
},
{
"resolution_limits": [3.66,3.40],
"number_observations_unique": 8875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.60
}
]
},
{
"resolution_limits": [4.03,3.66],
"number_observations_unique": 8907,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.60
}
]
},
{
"resolution_limits": [4.62,4.03],
"number_observations_unique": 8928,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.40
}
]
},
{
"resolution_limits": [5.81,4.62],
"number_observations_unique": 9034,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.10
}
]
},
{
"resolution_limits": [50.00,5.81],
"number_observations_unique": 9334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 10.20
}
]
}
]
}