Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6603c650c7c5a1236aa6a21784ff350b",
"space_group_name": "I 41",
"unit_cell": {
"a": 140.060,
"b": 140.060,
"c": 52.119,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.800],
"number_observations_unique": 23649,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.900,2.800],
"number_observations_unique": 2180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.376
},
{
"type": "Completeness",
"value": 89.400
},
{
"type": "Redundancy",
"value": 2.400
}
]
},
{
"resolution_limits": [3.020,2.900],
"number_observations_unique": 2317,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.306
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 2.600
}
]
},
{
"resolution_limits": [3.150,3.020],
"number_observations_unique": 2303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.234
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [3.320,3.150],
"number_observations_unique": 2384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [3.530,3.320],
"number_observations_unique": 2381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
{
"resolution_limits": [3.800,3.530],
"number_observations_unique": 2407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [4.180,3.800],
"number_observations_unique": 2385,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [4.790,4.180],
"number_observations_unique": 2435,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [6.030,4.790],
"number_observations_unique": 2446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
{
"resolution_limits": [50.000,6.030],
"number_observations_unique": 2411,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.500
}
]
}
]
}